Computer Physics Communications
Journal Impact IF - Analysis · Trend · Prediction · Ranking


New

Journal Impact IF

2019-2020

3.627

9.6%

Journal Impact IF Trend

Related Journals

Popular Journals

Computer Physics Communications

The 2019-2020 Journal Impact IF of Computer Physics Communications is 3.627, which is just updated in 2020.

Computer Physics Communications Impact Factor
Highest IF
3.936
Highest Journal Impact IF

The highest Journal Impact IF of Computer Physics Communications is 3.936.

Lowest IF
2.407
Lowest Journal Impact IF

The lowest Journal Impact IF of Computer Physics Communications is 2.407.

Total Growth Rate
11.0%
IF Total Growth Rate

The total growth rate of Computer Physics Communications IF is 11.0%.

Annual Growth Rate
1.2%
IF Annual Growth Rate

The annual growth rate of Computer Physics Communications IF is 1.2%.

Journal Impact IF Ranking

Subcategory Quartile Rank Percentile
Hardware and Architecture Q1 17/155

Hardware and Architecture 89%

General Physics and Astronomy Q1 22/224

General Physics and Astronomy 90%

Journal Impact IF Ranking

· In the Hardware and Architecture research field, the Quartile of Computer Physics Communications is Q1. Computer Physics Communications has been ranked #17 over 155 related journals in the Hardware and Architecture research category. The ranking percentile of Computer Physics Communications is around 89% in the field of Hardware and Architecture.
· In the General Physics and Astronomy research field, the Quartile of Computer Physics Communications is Q1. Computer Physics Communications has been ranked #22 over 224 related journals in the General Physics and Astronomy research category. The ranking percentile of Computer Physics Communications is around 90% in the field of General Physics and Astronomy.

Computer Physics Communications Impact Factor 2020-2021 Prediction

Computer Physics Communications Impact Factor Predition System

Computer Physics Communications Impact Factor Prediction System is now online. You can start share your valuable insights with the community.

Predict Check All Preditions
Total Publications
9939
Total Citations
428859

Annual Publication Volume

Annual Citation Record

International Collaboration Trend

Cited Documents Trend

Journal Impact IF History

Year Journal Impact IF
Year Journal Impact IF
2019-2020 3.627
2018-2019 3.309
2017-2018 3.748
2016-2017 3.936
2015-2016 3.635
2014-2015 3.112
2013-2014 2.407
2012-2013 3.078
2011-2012 3.268
Journal Impact IF History

· The 2019-2020 Journal Impact IF of Computer Physics Communications is 3.627
· The 2018-2019 Journal Impact IF of Computer Physics Communications is 3.309
· The 2017-2018 Journal Impact IF of Computer Physics Communications is 3.748
· The 2016-2017 Journal Impact IF of Computer Physics Communications is 3.936
· The 2015-2016 Journal Impact IF of Computer Physics Communications is 3.635
· The 2014-2015 Journal Impact IF of Computer Physics Communications is 3.112
· The 2013-2014 Journal Impact IF of Computer Physics Communications is 2.407
· The 2012-2013 Journal Impact IF of Computer Physics Communications is 3.078
· The 2011-2012 Journal Impact IF of Computer Physics Communications is 3.268

Publications Cites Dataset

Year Publications Citations
Year Publications Citations
1969 2 4
1970 6 7
1971 11 53
1972 74 86
1973 48 145
1974 26 196
1975 21 307
1976 27 384
1977 15 407
1978 43 435
1979 49 573
1980 51 657
1981 90 738
1982 86 799
1983 32 915
1984 772 1603
1985 144 1081
1986 149 1336
1987 180 1576
1988 160 1635
1989 261 2016
1990 162 2175
1991 238 2685
1992 178 3033
1993 152 3064
1994 156 3325
1995 193 3737
1996 145 3742
1997 169 4418
1998 187 4278
1999 422 5127
2000 272 4879
2001 316 5755
2002 321 6388
2003 148 7607
2004 201 8377
2005 235 9006
2006 154 10092
2007 237 10810
2008 210 11866
2009 281 12684
2010 248 13634
2011 369 16614
2012 272 19910
2013 299 21126
2014 335 23246
2015 300 27082
2016 282 28847
2017 326 29888
2018 189 32458
2019 291 35016
2020 271 39683
2021 133 3354
Publications Cites Dataset

· The Computer Physics Communications has published 2 reports and received 4 citations in 1969.
· The Computer Physics Communications has published 6 reports and received 7 citations in 1970.
· The Computer Physics Communications has published 11 reports and received 53 citations in 1971.
· The Computer Physics Communications has published 74 reports and received 86 citations in 1972.
· The Computer Physics Communications has published 48 reports and received 145 citations in 1973.
· The Computer Physics Communications has published 26 reports and received 196 citations in 1974.
· The Computer Physics Communications has published 21 reports and received 307 citations in 1975.
· The Computer Physics Communications has published 27 reports and received 384 citations in 1976.
· The Computer Physics Communications has published 15 reports and received 407 citations in 1977.
· The Computer Physics Communications has published 43 reports and received 435 citations in 1978.
· The Computer Physics Communications has published 49 reports and received 573 citations in 1979.
· The Computer Physics Communications has published 51 reports and received 657 citations in 1980.
· The Computer Physics Communications has published 90 reports and received 738 citations in 1981.
· The Computer Physics Communications has published 86 reports and received 799 citations in 1982.
· The Computer Physics Communications has published 32 reports and received 915 citations in 1983.
· The Computer Physics Communications has published 772 reports and received 1603 citations in 1984.
· The Computer Physics Communications has published 144 reports and received 1081 citations in 1985.
· The Computer Physics Communications has published 149 reports and received 1336 citations in 1986.
· The Computer Physics Communications has published 180 reports and received 1576 citations in 1987.
· The Computer Physics Communications has published 160 reports and received 1635 citations in 1988.
· The Computer Physics Communications has published 261 reports and received 2016 citations in 1989.
· The Computer Physics Communications has published 162 reports and received 2175 citations in 1990.
· The Computer Physics Communications has published 238 reports and received 2685 citations in 1991.
· The Computer Physics Communications has published 178 reports and received 3033 citations in 1992.
· The Computer Physics Communications has published 152 reports and received 3064 citations in 1993.
· The Computer Physics Communications has published 156 reports and received 3325 citations in 1994.
· The Computer Physics Communications has published 193 reports and received 3737 citations in 1995.
· The Computer Physics Communications has published 145 reports and received 3742 citations in 1996.
· The Computer Physics Communications has published 169 reports and received 4418 citations in 1997.
· The Computer Physics Communications has published 187 reports and received 4278 citations in 1998.
· The Computer Physics Communications has published 422 reports and received 5127 citations in 1999.
· The Computer Physics Communications has published 272 reports and received 4879 citations in 2000.
· The Computer Physics Communications has published 316 reports and received 5755 citations in 2001.
· The Computer Physics Communications has published 321 reports and received 6388 citations in 2002.
· The Computer Physics Communications has published 148 reports and received 7607 citations in 2003.
· The Computer Physics Communications has published 201 reports and received 8377 citations in 2004.
· The Computer Physics Communications has published 235 reports and received 9006 citations in 2005.
· The Computer Physics Communications has published 154 reports and received 10092 citations in 2006.
· The Computer Physics Communications has published 237 reports and received 10810 citations in 2007.
· The Computer Physics Communications has published 210 reports and received 11866 citations in 2008.
· The Computer Physics Communications has published 281 reports and received 12684 citations in 2009.
· The Computer Physics Communications has published 248 reports and received 13634 citations in 2010.
· The Computer Physics Communications has published 369 reports and received 16614 citations in 2011.
· The Computer Physics Communications has published 272 reports and received 19910 citations in 2012.
· The Computer Physics Communications has published 299 reports and received 21126 citations in 2013.
· The Computer Physics Communications has published 335 reports and received 23246 citations in 2014.
· The Computer Physics Communications has published 300 reports and received 27082 citations in 2015.
· The Computer Physics Communications has published 282 reports and received 28847 citations in 2016.
· The Computer Physics Communications has published 326 reports and received 29888 citations in 2017.
· The Computer Physics Communications has published 189 reports and received 32458 citations in 2018.
· The Computer Physics Communications has published 291 reports and received 35016 citations in 2019.
· The Computer Physics Communications has published 271 reports and received 39683 citations in 2020.
· The Computer Physics Communications has published 133 reports and received 3354 citations in 2021.
· The total publications of Computer Physics Communications is 9939.
· The total citations of Computer Physics Communications is 428859.

What is Impact Factor?

The impact factor (IF) or journal impact factor (JIF) of an academic journal is a scientometric index calculated by Clarivate that reflects the yearly average number of citations of articles published in the last two years in a given journal. It is frequently used as a proxy for the relative importance of a journal within its field; journals with higher impact factor values are often deemed to be more important, or carry more intrinsic prestige in their respective fields, than those with lower values.

Computer Physics Communications | Academic Accelerator - About the Impact Factor

Impact factor is commonly used to evaluate the relative importance of a journal within its field and to measure the frequency with which the “average article” in a journal has been cited in a particular time period. Journal which publishes more review articles will get highest IFs. Journals with higher IFs believed to be more important than those with lower ones. According to Eugene Garfield “impact simply reflects the ability of the journals and editors to attract the best paper available.” Journal which publishes more review articles will get maximum IFs. The Impact Factor of an academic journal is a scientometric Metric that reflects the yearly average number of citations that recent articles published in a given journal received. It is frequently used as a Metric for the relative importance of a journal within its field; journals with higher Impact Factor are often deemed to be more important than those with lower ones. The Computer Physics Communications Impact Factor IF measures the average number of citations received in a particular year (2020) by papers published in the Computer Physics Communications during the two preceding years (2018-2019). Note that 2020 Impact Factor are reported in 2021; they cannot be calculated until all of the 2020 publications have been processed by the indexing agency. New journals, which are indexed from their first published issue, will receive an impact factor after two years of indexing; in this case, the citations to the year prior to Volume 1, and the number of articles published in the year prior to Volume 1, are known zero values. Journals that are indexed starting with a volume other than the first volume will not get an impact factor until they have been indexed for three years. Occasionally, Journal Citation Reports assigns an impact factor to new journals with less than two years of indexing, based on partial citation data. The calculation always uses two complete and known years of item counts, but for new titles one of the known counts is zero. Annuals and other irregular publications sometimes publish no items in a particular year, affecting the count. The impact factor relates to a specific time period; it is possible to calculate it for any desired period. In addition to the 2-year Impact Factor, the 3-year Impact Factor, 4-year Impact Factor, 5-year Impact Factor, Real-Time Impact Factor can provide further insights and factors into the impact of Computer Physics Communications.

History

The impact factor was devised by Eugene Garfield, the founder of the Institute for Scientific Information (ISI). Impact factors are calculated yearly starting from 1975 for journals listed in the Journal Citation Reports (JCR). ISI was acquired by Thomson Scientific & Healthcare in 1992, and became known as Thomson ISI. In 2018, Thomson ISI was sold to Onex Corporation and Baring Private Equity Asia. They founded a new corporation, Clarivate, which is now the publisher of the JCR.

Use

The impact factor is used to compare different journals within a certain field. The Web of Science indexes more than 11,500 science and social science journals. Journal impact factors are often used to evaluate the merit of individual articles and individual researchers. This use of impact factors was summarised by Hoeffel:

Impact Factor is not a perfect tool to measure the quality of articles but there is nothing better and it has the advantage of already being in existence and is, therefore, a good technique for scientific evaluation. Experience has shown that in each specialty the best journals are those in which it is most difficult to have an article accepted, and these are the journals that have a high impact factor. Most of these journals existed long before the impact factor was devised. The use of impact factor as a measure of quality is widespread because it fits well with the opinion we have in each field of the best journals in our specialty....In conclusion, prestigious journals publish papers of high level. Therefore, their impact factor is high, and not the contrary.

Eugene Garfield

In brief, Impact factors may be used by:
  • Authors to decide where to submit an article for publication.
  • Libraries to make collection development decisions
  • Academic departments to assess academic productivity
  • Academic departments to make decisions on promotion and tenure.
As impact factors are a journal-level metric, rather than an article- or individual-level metric, this use is controversial. Garfield agrees with Hoeffel,but warns about the "misuse in evaluating individuals" because there is "a wide variation [of citations] from article to article within a single journal". Other things to consider about Impact Factors:
  • Many journals do not have an impact factor.
  • The impact factor cannot assess the quality of individual articles. Even if citations were evenly distributed among articles, the impact factor would only measure the interests of other researchers in an article, not its importance and usefulness.
  • Only research articles, technical notes and reviews are “citable” items. Editorials, letters, news items and meeting abstracts are “non-citable items”.
  • Only a small percentage of articles are highly cited and they are found in a small subset of journals. This small proportion accounts for a large percentage of citations.
  • Controversial papers, such as those based on fraudulent data, may be highly cited, distorting the impact factor of a journal.
  • Citation bias may exist. For example, English language resources may be favoured. Authors may cite their own work.
Moreover, informed and careful use of these impact data is essential, and should be based on a thorough understanding of the methodology used to generate impact factors. There are controversial aspects of using impact factors:
  • It is not clear whether the number of times a paper is cited measures its actual quality.
  • Some databases that calculate impact factors fail to incorporate publications including textbooks, handbooks and reference books.
  • Certain disciplines have low numbers of journals and usage. Therefore, one should only compare journals or researchers within the same discipline.
  • Review articles normally are cited more often and therefore can skew results.
  • Self-citing may also skew results.
  • Some resources used to calculate impact factors have inadequate international coverage.
  • Editorial policies can artificially inflate an impact factor.
Impact factors have often been used in advancement and tenure decision-making. Many recognize that this is a coarse tool for such important decisions, and that a multitude of factors should be taken into account in these deliberations. When considering the use of the impact factor (IF), keep these aspects in mind:
  • IF analysis is limited to citations from the journals indexed by the Web of Science/Web of Knowledge. Currently, the Web of Science indexes only 8621 journals across the full breadth of the sciences, and just 3121 in the social sciences.
  • A high IF/citation rate says nothing about the quality -- or even, validity -- of the references being cited. Notorious or even retracted articles often attract a lot of attention, hence a high number of citations. The notority related to the first publication on "cold fusion" is one such example.
  • Journals that publish more "review articles" are often found near the top of the rankings. While not known for publishing new, creative findings, these individual articles tend to be heavily cited.
  • The IF measures the average number of citations to articles in the journal -- given this, a small number of highly-cited articles will skew the figure.
  • It takes several years for new journals to be added to the list of titles indexed by the Web of Science/Web of Knowledge, so these newer titles will be under-represented.
  • It's alleged that journal editors have learned to "game" the system, encouraging authors to cite their works previously published in the same journal.
Comparing Journals Across Disciplines? Not a good idea! Using Impact Factors within a given discipline should only be done with great care, as described above. Using impact factor data to compare journals across disciplines is even more problematic. Here are some of the reasons:
  • Disciplines where older literature is still referenced, such as Chemistry and Mathematics, offer challenges to the methodolgy since older citations (older than two years) are not used to calculate the impact factor for a given journal. (Five-year impact factor analysis, which can be calculated using the Journal Citation Index database, helps smooth out this problem only to some degree.)
  • Different disciplines have different practices regarding tendency to cite larger numbers of references. Higher overall citation rates will bump upward impact factor measurements.
  • Where it's common for large numbers of authors to collaborate on a single paper, such as in Physics, the tendency of authors to cite themselves (and in this case, more authors) will result in increased citation rates.

Pros and Cons of the Impact Factor

Pros:

  • A vetted, established metric for measuring journal impact within a discipline.
  • Designed to eliminate bias based on journal size and frequency.
Cons:
  • Individual articles makes an uneven contribution to overall Impact Factor.
  • Impact Factor does not account for certain things, things like context (postive or negative citaion) and intentionality (self-citation).
  • The metric is proprietary to and bound by the contents of the Thomson Reuters database.
  • Citations, on which the Impact Factor is based, count for less than 1% of an article's overall use.

Criticism

Numerous critiques have been made regarding the use of impact factors. A 2007 study noted that the most fundamental flaw is that impact factors present the mean of data that are not normally distributed, and suggested that it would be more appropriate to present the median of these data. There is also a more general debate on the validity of the impact factor as a measure of journal importance and the effect of policies that editors may adopt to boost their impact factor (perhaps to the detriment of readers and writers). Other criticism focuses on the effect of the impact factor on behavior of scholars, editors and other stakeholders. Others have made more general criticisms, arguing that emphasis on impact factor results from negative influence of neoliberal policies on academia claiming that what is needed is not just replacement of the impact factor with more sophisticated metrics for science publications but also discussion on the social value of research assessment and the growing precariousness of scientific careers in higher education.
Experts stress that there are limitations in using impact factors to evaluate a scholar's work. There are many reasons cited for not relying on impact factor alone to evaluate the output of a particular individual. Among these are the following:

  • A single factor is not sufficient for evaluating an author's work.
  • Journal values are meaningless unless compared within the same discipline. Impact factors vary among disciplines.
  • The impact factor was originally devised to show the impact of a specific journal, not a specific scholar. The quality and impact of the author's work may extend beyond the impact of a particular journal.
According to Jim Testa, a researcher for ThomsonReuters Scientific, the most widespread misuse of the Impact Factor is to evaluate the work of an individual author (instead of a journal). "To say that because a researcher is publishing in a certain journal, he or she is more influential or deserves more credit is not necessarily true. There are many other variables to consider." (interview 6/26/2008 in Thomson Reuters blog entry)

Computer Physics Communications
Journal Profile

About

The focus of CPC is on contemporary computational methods and techniques and their implementation, the effectiveness of which will normally be evidenced by the author(s) within the context of a substantive problem in physics. Within this setting CPC publishes two types of paper.Computer Programs in Physics (CPiP)These papers describe significant computer programs to be archived in the CPC Program Library which is held in the Mendeley Data repository. The submitted software must be covered by an approved open source licence. Papers and associated computer programs that address a problem of contemporary interest in physics that cannot be solved by current software are particularly encouraged.Computational Physics Papers (CP)These are research papers in, but are not limited to, the following themes across computational physics and related disciplines.mathematical and numerical methods and algorithms;computational models including those associated with the design, control and analysis of experiments; andalgebraic computation.Each will normally include software implementation and performance details. The software implementation should, ideally, be available via GitHub, Zenodo or an institutional repository.In addition, research papers on the impact of advanced computer architecture and special purpose computers on computing in the physical sciences and software topics related to, and of importance in, the physical sciences may be considered. Computer Physics Communications is a peer-reviewed scientific journal published by Elsevier under the North-Holland imprint. The journal focuses on computational methodology, numerical analysis and hardware and software development in support of physics and physical chemistry. Associated with the journal is the Computer Physics Communications Program Library. This resource houses computer programs which have been described in the journal. Access to the library is bundled with journal subscriptions, although those unaffiliated with a subscribing institution can purchase individual subscriptions.

Highly Cited Keywords

ISSN
0010-4655
ISSN

The ISSN of Computer Physics Communications is 0010-4655 . An ISSN is an 8-digit code used to identify newspapers, journals, magazines and periodicals of all kinds and on all media–print and electronic.

ISSN (Online)
-
ISSN (Online)

The ISSN (Online) of Computer Physics Communications is - . An ISSN is an 8-digit code used to identify newspapers, journals, magazines and periodicals of all kinds and on all media–print and electronic.

Publisher
Elsevier
Publisher

Computer Physics Communications is published by Elsevier .

Publication Frequency
-
Publication Frequency

Computer Physics Communications publishes reports - .

Coverage
1969 - Present
Coverage

The Publication History of Computer Physics Communications covers 1969 - Present .

Open Access
NO
Open Access

Computer Physics Communications is Subscription-based (non-OA) Journal. Publishers own the rights to the articles in their journals. Anyone who wants to read the articles should pay by individual or institution to access the articles. Anyone who wants to use the articles in any way must obtain permission from the publishers.

Publication Fee
Publication Fee

There is no publication fee for submiting manuscript to Computer Physics Communications. Computer Physics Communications is Subscription-based (non-OA) Journal. Publishers own the rights to the articles in their journals. Anyone who wants to read the articles should pay by individual or institution to access the articles.

Language
-
Language

The language of Computer Physics Communications is - .

Country/Region
Netherlands
Country/Region

The publisher of Computer Physics Communications is Elsevier , which locates in Netherlands .

Selected Articles

Full Title Authors
Full Title Authors
Finite size effects in active microrheology in colloids Christopher D. Cooper · Christopher D. Cooper · Lorena A. Barba · Lorena A. Barba
X- factor: A modified relaxation factor to accelerate the convergence rate of the radiative transfer equation with high-order resolution schemes using the Normalized Weighting-Factor method Valerio D’Alessandro · Lorenzo Binci · Sergio Montelpare · Renato Ricci · Renato Ricci
A simulation environment to simulate lower-hybrid-wave-driven plasmas efficiently Mathias Schwendt · Walter Pötz · Walter Pötz
Well-balanced open boundary condition in a lattice Boltzmann model for shallow water with arbitrary bathymetry P. Domínguez-García · Manuel Pancorbo · Francisco Ortega · Miguel A. Rubio · Miguel A. Rubio
Transparent boundary conditions for the Bogoliubov–de Gennes equation in (1+1)D Kaifeng Chen · Bo Zhao · Shanhui Fan · Shanhui Fan
JColloids: Image analysis for video-microscopy studies of colloidal suspensions Tao Jiang · Tao Jiang · Zhengchao Chen · Weigang Lu · Jin-Yun Yuan · Deng-Shan Wang · Deng-Shan Wang
MESH: A free electromagnetic solver for far-field and near-field radiative heat transfer for layered periodic structures J. Xamán · I. Hernández-López · J. Uriarte-Flores · I. Hernández-Pérez · I. Zavala-Guillén · P. Moreno-Bernal · J.F. Hinojosa · J.F. Hinojosa
An efficient split-step and implicit pure mesh-free method for the 2D/3D nonlinear Gross–Pitaevskii equations Matthieu Lemaire · Hyunsuk Lee · Bamidele Ebiwonjumi · Chidong Kong · Wonkyeong Kim · Yunki Jo · Jinsu Park · Deokjung Lee · Deokjung Lee
Verification of photon transport capability of UNIST Monte Carlo code MCS Eliseo Garcia · Javier Moreno · Felipe Cátedra · Felipe Cátedra
CellSim3D: GPU accelerated software for simulations of cellular growth and division in three dimensions Công Tâm Tran · Benoît Crespin · Manuella Cerbelaud · Arnaud Videcoq · Arnaud Videcoq
On the development of OpenFOAM solvers based on explicit and implicit high-order Runge–Kutta schemes for incompressible flows with heat transfer Iain Bethune · Ralf Banisch · Elena Breitmoser · Antonia Collis · Gordon Gibb · Gianpaolo Gobbo · Charles Matthews · Graeme Ackland · Benedict Leimkuhler · Benedict Leimkuhler
Speeding-up the CBFM–MLFMA approach for scattering analysis of very large electromagnetic problems John Gounley · Madhurima Vardhan · Amanda Randles · Amanda Randles
MIST: A simple and efficient molecular dynamics abstraction library for integrator development Hua Shen · Matteo Parsani · Matteo Parsani
A framework for comparing vascular hemodynamics at different points in time Eelis Solala · Pauli Parkkinen · Dage Sundholm · Dage Sundholm · Dage Sundholm
Positivity-preserving CE/SE schemes for solving the compressible Euler and Navier–Stokes equations on hybrid unstructured meshes Wesley J.M. Ridgway · Alexei F. Cheviakov · Alexei F. Cheviakov
Tensor decompositions for the bubbles and cube numerical framework Pranav Madhikar · Jan Åström · Mikko Karttunen · Mikko Karttunen
Efficient data-driven reduced-order models for high-dimensional multiscale dynamical systems Álvaro Salinas · Claudio E. Torres · Orlando Ayala · Orlando Ayala
Kohn–Sham approach for fast hybrid density functional calculations in real-space numerical grid methods B. Roidl · Y. Todo · Y. Takase · N. Tsujii · A. Ejiri · Yusuke Yoshida · S. Yajima · T. Shinya · T. Shinya
BREMS: A program for calculating spectra and angular distributions of bremsstrahlung at electron energies less than 3 MeV Souvik Chakraborty · Nicholas Zabaras · Nicholas Zabaras
A lifted local Galerkin method for solving the reaction–diffusion equations on implicit surfaces Jaewook Kim · Sungwoo Kang · Jaechang Lim · Sang-Yeon Hwang · Woo Youn Kim · Woo Youn Kim
ORTHOPOLY: A library for accurate evaluation of series of classical orthogonal polynomials and their derivatives Andrius Poškus · Andrius Poškus
Fully-implicit finite volume method for the ideal two-fluid plasma model Xufeng Xiao · Kun Wang · Xinlong Feng · Xinlong Feng
An alternative algorithm for the linearization process of transmutation and decay networks Roberto Barrio · Peibing Du · Hao Jiang · Sergio Serrano · Sergio Serrano
CHIWEI: A code of goodness of fit tests for weighted and unweighted histograms in Fortran-77, C++, R and Python A. Alvarez Laguna · A. Alvarez Laguna · N. Ozak · Andrea Lani · Herman Deconinck · Stefaan Poedts · Stefaan Poedts
GPU-acceleration on a low-latency binary-coalescence gravitational wave search pipeline Carlos-Antonio Cruz-López · Juan-Luis François · Juan-Luis François
Simulating electron wave dynamics in graphene superlattices exploiting parallel processing advantages Nikolay D. Gagunashvili · Helgi Halldorsson · Helgi Halldorsson
AACSD: An atomistic analyzer for crystal structure and defects Xiangyu Guo · Qi Chu · Shin Kee Chung · Zhihui Du · L. Wen · Yanqi Gu · Yanqi Gu
The TDHF code Sky3D version 1.1 Manuel Rodrigues · David E. Fernandes · Mário G. Silveirinha · Mário G. Silveirinha · Gabriel Falcao · Gabriel Falcao
An ADER discontinuous Galerkin method with local time-stepping for transient electromagnetics Z.R. Liu · R.F. Zhang · R.F. Zhang
Accuracy and stability enhancements in the incompressible finite-volume-particle method for multiphase flow simulations Bastian Schuetrumpf · Bastian Schuetrumpf · P.-G. Reinhard · P. D. Stevenson · A. S. Umar · J. A. Maruhn · J. A. Maruhn
A block Jacobi method for complex skew-symmetric matrices with applications in the time-dependent variational principle Hongxin Qi · Xianghui Wang · Jie Zhang · Jianguo Wang · Jianguo Wang
mxpfit: A library for finding optimal multi-exponential approximations Xiaoxing Liu · Ryusei Ogawa · Masatsugu Kato · Koji Morita · Shuai Zhang · Shuai Zhang
Application of genetic algorithms to modelings of fusion plasma physics Alexander Humeniuk · Roland Mitrić · Roland Mitrić
An iterative procedure for finding locally and globally optimal arrangements of particles on the unit sphere Joan Adler · Sampo Kulju · Jari Hyväluoma · Keijo Mattila · Keijo Mattila · Kit Choi · Ioannis Tziakos · Didrik Pinte · G.A. García · Y. Makushok · V. Makushok · J. Lama · G. Román-Pérez · Adham Hashibon · Mehdi Sadeghi · Nathan Franklin · Amihai Silverman · Amihai Silverman
Visualization in the integrated SimPhoNy multiscale simulation framework Cheng Liu · Changhong Hu · Changhong Hu
Accelerating Hybrid Monte Carlo simulations of the Hubbard model on the hexagonal lattice M. Honda · M. Honda
Making simulations with the MNPBEM toolbox big: Hierarchical matrices and iterative solvers W. Gins · R.P. de Groote · Mark Bissell · C Granados Buitrago · R. Ferrer · K. M. Lynch · G. Neyens · S. Sels · S. Sels
Calculation of higher-order moments by higher-order tensor renormalization group Christoph Dalitz · Y. Ayyad · Jens Wilberg · Lukas Aymans · D. Bazin · W. Mittig · W. Mittig
GenASiS Mathematics : Object-oriented manifolds, operations, and solvers for large-scale physics simulations ☆ N. Auer · Lukas Einkemmer · Peter Kandolf · Alexander Ostermann · Alexander Ostermann
Automatic trajectory recognition in Active Target Time Projection Chambers data by means of hierarchical clustering Prithish Halder · H. S. Das · H. S. Das
Magnus integrators on multicore CPUs and GPUs I.I. Gontchar · I.I. Gontchar · M.V. Chushnyakova · M.V. Chushnyakova · M.V. Chushnyakova
DFMDEF18: A C-code for the double folding interaction potential of a spherical nucleus with deformed nucleus Junseok Kim · Hyun Geun Lee · Hyun Geun Lee
Grand Canonical adaptive resolution simulation for molecules with electrons: A theoretical framework based on physical consistency Henry Lambert · Adam Fekete · James R. Kermode · A. De Vita · A. De Vita
Imeall: A computational framework for the calculation of the atomistic properties of grain boundaries D. Buaria · D. Buaria · P. K. Yeung · P. K. Yeung
Colloidal suspension by SRD–MD simulation on GPU Abbas Khayyer · Hitoshi Gotoh · Hosein Falahaty · Yuma Shimizu · Yuma Shimizu
Analysis of counting data: Development of the SATLAS Python package Shinya Kanemura · Mariko Kikuchi · Kodai Sakurai · Kei Yagyu · Kei Yagyu
H-COUP: a program for one-loop corrected Higgs boson couplings in non-minimal Higgs sectors Peter Athron · Markus Bach · Dylan Harries · Dylan Harries · Thomas Kwasnitza · Jae-hyeon Park · Dominik Stöckinger · Alexander Voigt · Jobst Ziebell · Jobst Ziebell
Voronoi Tessellation for reducing the processing time of correlation functions Vladimir V. Bytev · Vladimir V. Bytev · Bernd A. Kniehl · Bernd A. Kniehl
FlexibleSUSY 2.0: Extensions to investigate the phenomenology of SUSY and non-SUSY models Julien Derouillat · Arnaud Beck · Frédéric Pérez · T. Vinci · M. Chiaramello · A. Grassi · A. Grassi · M. Flé · G. Bouchard · I. Plotnikov · N. Aunai · J. Dargent · J. Dargent · C. Riconda · M. Grech · M. Grech
Smilei : A collaborative, open-source, multi-purpose particle-in-cell code for plasma simulation Jonatan Núñez-de la Rosa · Jonatan Núñez-de la Rosa · Claus-Dieter Munz · Claus-Dieter Munz
Curvature computation in volume-of-fluid method based on point-cloud sampling Holger Homann · François Laenen · François Laenen
New massively parallel scheme for Incompressible Smoothed Particle Hydrodynamics (ISPH) for highly nonlinear and distorted flow Christian Y. Cardall · Christian Y. Cardall · Reuben D. Budiardja · Reuben D. Budiardja · Reuben D. Budiardja
DIST: A dislocation-simulation toolkit Satoshi Morita · Naoki Kawashima · Naoki Kawashima
The F-t-Pj-RG method: An adjacent-rolling-windows based steady-state detection technique for application to kinetic Monte Carlo simulations Xiaohu Guo · Benedict D. Rogers · Steven Lind · Peter Stansby · Peter Stansby
A high-order cross-platform incompressible Navier–Stokes solver via artificial compressibility with application to a turbulent jet Zongrui Pei · Zongrui Pei · Zongrui Pei
New version of FDTD with GFM program in Schwarzschild space-time Chris Nellis · Thomas Danielson · Aditya Savara · Celine Hin · Celine Hin
SHAVEL: A program for the spherical harmonic analysis of a horizontal vector field sampled in an equiangular grid on a sphere N. A. Loppi · Freddie D. Witherden · Antony Jameson · Peter E. Vincent · Peter E. Vincent
Corrigendum toConfiguration interactions of class 11: An error in Cowans atomic structure theory[Comput. Phys. Commun. 215 (2017) 47–48] Shouqing Jia · Shouqing Jia
Generalized mode solver for plasmonic transmission lines embedded in layered media based on the Method of Moments Zdeněk Martinec · Zdeněk Martinec · David Einšpigel · David Einšpigel
EPAW-1.0 code for evolutionary optimization of PAW datasets especially for high-pressure applications Alexander Kramida · Alexander Kramida
Torricelli: A software to determine atomic spatial distributions from normal incidence x-ray standing wave data Mai O. Sallam · Mai O. Sallam · Mai O. Sallam · Guy A. E. Vandenbosch · Georges Gielen · Ezzeldin A. Soliman · Ezzeldin A. Soliman
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ARUZ — Large-scale, massively parallel FPGA-based analyzer of real complex systems François C. Bocquet · G. Mercurio · Markus Franke · G. van Straaten · S. Weiß · Serguei Soubatch · Christian Kumpf · F.S. Tautz · F.S. Tautz
Capture cross section with quantum diffusion approach Igor Mosyagin · Igor Mosyagin · A.V. Lugovskoy · O.M. Krasilnikov · Yu.Kh. Vekilov · Sergei I. Simak · Igor A. Abrikosov · Igor A. Abrikosov
GDB: A global 3D two-fluid model of plasma turbulence and transport in the tokamak edge Rafal Kielbik · Krzysztof Hałagan · Witold Zatorski · Jaroslaw Jung · Jacek Ulanski · Andrzej Napieralski · Kamil Rudnicki · Piotr Amrozik · Grzegorz Jablonski · Dominik Stożek · Piotr Polanowski · Zbigniew Mudza · Joanna Kupis · Przemysław Panek · Przemysław Panek
Q2DTor: A program to treat torsional anharmonicity through coupled pair torsions in flexible molecules V.V. Sargsyan · V.V. Sargsyan · S.Yu. Grigoryev · G.G. Adamian · N.V. Antonenko · N.V. Antonenko · N.V. Antonenko
An enhanced ISPH–SPH coupled method for simulation of incompressible fluid–elastic structure interactions Ben Zhu · Ben Zhu · Manaure Francisquez · Barrett N. Rogers · Barrett N. Rogers
Block-based adaptive mesh refinement for fluid–structure interactions in incompressible flows David Ferro-Costas · David Ferro-Costas · M. Natália D. S. Cordeiro · Donald G. Truhlar · Antonio Fernández-Ramos · Antonio Fernández-Ramos
PASTA: Python Algorithms for Searching Transition stAtes Hidekazu Ikeno · Hidekazu Ikeno · Hidekazu Ikeno
Diagonalizing the Hamiltonian of λϕ4 theory in 2 space–time dimensions Mcj Maarten Hornikx · Tf Thomas Krijnen · Louis van Harten · Louis van Harten
Accurate artificial boundary conditions for the semi-discretized linear Schrödinger and heat equations on rectangular domains Cesar Ayala · Gorazd Cvetic · Gorazd Cvetic
PyCDT: A Python toolkit for modeling point defects in semiconductors and insulators Thomas Kjærgaard · Pablo Baudin · Dmytro Bykov · Janus Juul Eriksen · Patrick Ettenhuber · Kasper Kristensen · Jeff Larkin · Dmitry Liakh · Filip Pawłowski · Aaron Vose · Yang Min Wang · Poul Jørgensen · Poul Jørgensen
TNSPackage: A Fortran2003 library designed for tensor network state methods Philipp Neumann · Philipp Neumann · Xin Bian · Xin Bian · Xin Bian
Asymptotic-Preserving scheme for a strongly anisotropic vorticity equation arising in fusion plasma modeling Toni Giorgino · Alessandro Laio · Alex Rodriguez · Alex Rodriguez
pySecDec: a toolbox for the numerical evaluation of multi-scale integrals William Robert Saunders · James Grant · Eike Hermann Müller · Eike Hermann Müller
A time-spectral approach to numerical weather prediction Wesley Cota · Silvio C. Ferreira · Silvio C. Ferreira
Massively parallel implementation and approaches to simulate quantum dynamics using Krylov subspace techniques Blaise Faugeras · Jacques Blum · Holger Heumann · C. Boulbe · C. Boulbe
Multiscale Particle-in-Cell methods and comparisons for the long-time two-dimensional Vlasov-Poisson equation with strong magnetic field Alexander Humeniuk · Roland Mitrić · Roland Mitrić
Transfer matrix algorithm for computing the exact partition function of a square lattice polymer Francesco Fambri · Michael Dumbser · Olindo Zanotti · Olindo Zanotti
Aspects of perturbation theory in quantum mechanics: The BenderWu Mathematica ® package L.Gr. Ixaru · L.Gr. Ixaru
TAUOLA of τ lepton decays—framework for hadronic currents, matrix elements and anomalous decays M. Chilenski · I. Faust · J. Walk · J. Walk
MITHRA 1.0: A full-wave simulation tool for free electron lasers Daniel Winkler · Michael Meister · Massoud Rezavand · Wolfgang Rauch · Wolfgang Rauch
Afivo: A framework for quadtree/octree AMR with shared-memory parallelization and geometric multigrid methods Mikhail M. Basko · Ilia P. Tsygvintsev · Ilia P. Tsygvintsev
MultivariateResidues - a Mathematica package for computing multivariate residues R. López · Jaime Fernández Rico · G. Ramírez · I. Ema · David Zorrilla · Anmol Kumar · Sachin D. Yeole · Shridhar R. Gadre · Shridhar R. Gadre · Shridhar R. Gadre
Adaptive time-stepping Monte Carlo integration of Coulomb collisions Christoph Junghans · Animesh Agarwal · Luigi Delle Site · Luigi Delle Site
Accelerating finite-rate chemical kinetics with coprocessors: Comparing vectorization methods on GPUs, MICs, and CPUs Weipeng Jing · Danyu Tong · Yangang Wang · Jingyuan Wang · Yaqiu Liu · Peng Zhao · Peng Zhao
The psml format and library for norm-conserving pseudopotential data curation and interoperability A. Butykai · P. Domínguez-García · F.M. Mor · R. Gaál · László Forró · Sylvia Jeney · Sylvia Jeney
Coupling boundary condition for high-intensity electric arc attached on a non-homogeneous refractory cathode Shao-Jun Dong · Wenyuan Liu · Chao Wang · Yong-Jian Han · G.-C. Guo · Lixin He · Lixin He
A computational approach to the structural analysis of uncertain kinetic systems Mit H. Naik · Manish Jain · Manish Jain
AFiD-GPU: a versatile Navier-Stokes Solver for Wall-Bounded Turbulent Flows on GPU Clusters Zheyong Fan · Zheyong Fan · Ville Vierimaa · Ari Harju · Ari Harju
CoFFEE: Corrections For Formation Energy and Eigenvalues for charged defect simulations Jeffrey Kelling · Géza Ódor · Sibylle Gemming · Sibylle Gemming · Sibylle Gemming
GPUQT: An efficient linear-scaling quantum transport code fully implemented on graphics processing units K. Muraleedhara Varier · V. Sankar · M.P. Gangadathan · M.P. Gangadathan
Ultrahigh-order Maxwell solver with extreme scalability for electromagnetic PIC simulations of plasmas Takashi Koretsune · Ryotaro Arita · Ryotaro Arita
Algorithmic transformation of multi-loop master integrals to a canonical basis with CANONICA Valentin Niess · Anne Barnoud · Cristina Cârloganu · Eve Le Ménédeu · Eve Le Ménédeu
Backward Monte-Carlo applied to muon transport P. Maierhöfer · J. Usovitsch · J. Usovitsch · Peter Uwer · Peter Uwer
Kira—A Feynman integral reduction program Bailu Yan · Zheng Zhao · Yingcheng Zhou · Wenyan Yuan · Jian Li · Jun Wu · Daojian Cheng · Daojian Cheng
WavePacket: A Matlab package for numerical quantum dynamics.II: Open quantum systems, optimal control, and model reduction Lucas Calderin · Valentin V. Karasiev · S. B. Trickey · S. B. Trickey
ELSI: A unified software interface for Kohn–Sham electronic structure solvers D. Hall · D. Hall
Efficient technique for computational design of thermoelectric materials L. Gutierrez Marcantoni · L. Gutierrez Marcantoni · José P. Tamagno · Sergio Elaskar · Sergio Elaskar · Sergio Elaskar
Optimizing Event Selection with the Random Grid Search Charlotte Boukandou-Mombo · Hassan Bakrim · Jonathan Claustre · J. Margot · J. P. Matte · F. Vidal · F. Vidal
OpTHyLiC : An Optimised Tool for Hybrid Limits Computation E. Busato · D. Calvet · Timothée Theveneaux-Pelzer · Timothée Theveneaux-Pelzer · Timothée Theveneaux-Pelzer
QuantumOptics.jl: A Julia framework for simulating open quantum systems Stefan Schnabel · Wolfhard Janke · Wolfhard Janke
Scalable nuclear density functional theory with Sky3D Ian Halliday · Sergey V. Lishchuk · Timothy Spencer · Kallum Burgin · Torsten Schenkel · Torsten Schenkel
Accelerating Nuclear Configuration Interaction Calculations through a Preconditioned Block Iterative Eigensolver Christopher P. Stone · Andrew T. Alferman · Kyle E. Niemeyer · Kyle E. Niemeyer
LHC collider phenomenology of minimal universal extra dimensions László Gyevi-Nagy · Gyula Tasi · Gyula Tasi
Afterlive: A performant code for Vlasov-Hybrid simulations Stefan Krieg · Thomas Luu · Johann Ostmeyer · Philippos Papaphilippou · Carsten Urbach · Carsten Urbach
Fission Reaction Event Yield Algorithm FREYA 2.0.2 Roberto da Silva · Henrique A. Fernandes · Henrique A. Fernandes
A three-step Boris integrator for Lorentz force equation of charged particles Jan Eichstädt · Mashy D. Green · Michael Turner · Joaquim Peiró · David Moxey · David Moxey
Algebraic techniques for eigenvalues and eigenvectors of a split quaternion matrix in split quaternionic mechanics C. E. Starrett · N. M. Gill · T. Sjostrom · C. W. Greeff · C. W. Greeff
Accelerating high-order mesh optimisation with an architecture-independent programming model Walter C. Ermler · Walter C. Ermler
Wide ranging equation of state with Tartarus: A hybrid Greens function/orbital based average atom code William Cunningham · Dmitri V. Krioukov · Dmitri V. Krioukov
jj-Coupling-based atomic self-consistent-field calculations with relativistic effective core potentials and two-component spinors J.M. Verbeke · Jørgen Randrup · R. Vogt · R. Vogt · R. Vogt
Causal set generator and action computer Shuyao Hu · Chongwen Jiang · Zhenxun Gao · Chun-Hian Lee · Chun-Hian Lee
Disturbance region update method for steady compressible flows Boris I. Krasnopolsky · Boris I. Krasnopolsky
Simflowny 2: An upgraded platform for scientific modelling and simulation Vladislav S. Yakovlev · Michael S. Wismer · Michael S. Wismer
Highly detailed computational study of a surface reaction model with diffusion: Four algorithms analyzed via time-dependent and steady-state Monte Carlo simulations Rinat Khaziev · Davide Curreli · Davide Curreli
An approach for accelerating incompressible turbulent flow simulations based on simultaneous modelling of multiple ensembles Masashi Noda · Shunsuke A. Sato · Yuta Hirokawa · Mitsuharu Uemoto · Takashi Takeuchi · Shunsuke Yamada · Atsushi Yamada · Yasushi Shinohara · Maiku Yamaguchi · Kenji Iida · Isabella Floss · Tomohito Otobe · Kyungmin Lee · Kazuya Ishimura · Taisuke Boku · G. F. Bertsch · Katsuyuki Nobusada · Kazuhiro Yabana · Kazuhiro Yabana
Reliability of the time splitting Fourier method for singular solutions in quantum fluids B. V. Costa · L.A.S. Mól · J.C.S. Rocha · J.C.S. Rocha
hPIC: A scalable electrostatic Particle-in-Cell for Plasma–Material Interactions Bhaskar Chaudhury · Anurag Gupta · Henil Shah · Saumya Bhadani · Saumya Bhadani
SALMON: Scalable Ab-initio Light–Matter simulator for Optics and Nanoscience Patrick Kilian · Cedric Schreiner · Felix Spanier · Felix Spanier
Accelerated simulation of microwave breakdown in gases on Xeon Phi based cluster-application to self-organized plasma pattern formation Frédéric Magniette · Frédéric Magniette
The LS-STAG immersed boundary/cut-cell method for non-Newtonian flows in 3D extruded geometries Tongsong Jiang · Zhaozhong Zhang · Ziwu Jiang · Ziwu Jiang
Parameter estimation in IMEX-trigonometrically fitted methods for the numerical solution of reaction–diffusion problems Takayuki Umeda · Takayuki Umeda
Simulation of the pulse propagation by the interacting mode parabolic equation method Farhad Nikfarjam · Yoann Cheny · Olivier Botella · Olivier Botella
Calculation of two-dimension radial electric field in boundary plasmas by using BOUT++ Raffaele D’Ambrosio · Martina Moccaldi · Beatrice Paternoster · Beatrice Paternoster
Maxis—A rezoning and remapping code in two dimensional cylindrical geometry M.Yu. Trofimov · Sergey B. Kozitskiy · A. D. Zakharenko · A. D. Zakharenko
Schnek: A C++ library for the development of parallel simulation codes on regular grids N. M. Li · X.-Q. Xu · Thomas D. Rognlien · B. Gui · J. Z. Sun · D. Z. Wang · D. Z. Wang
The equation of state package FEOS for high energy density matter Zhiwei Lin · Shaoen Jiang · Lu Zhang · Longyu Kuang · Hang Li · Hang Li
Brillouin zone grid refinement for highly resolved ab initio THz optical properties of graphene Holger Schmitz · Holger Schmitz
SModelS v1.1 user manual: Improving simplified model constraints with efficiency maps S. Faik · A. Tauschwitz · Igor Iosilevskiy · Igor Iosilevskiy
BOPfox program for tight-binding and analytic bond-order potential calculations Robert Warmbier · Alexander Quandt · Alexander Quandt
Collider limits on new physics within micrOMEGAs_4.3 Peter Falloon · Jeremy P. J. Rodriguez · Jingbo Wang · Jingbo Wang
Performance profiling for brachytherapy applications Federico Ambrogi · Sabine Kraml · Suchita Kulkarni · Ursula Laa · Andre Lessa · Veronika Magerl · Jory Sonneveld · Michael Traub · Wolfgang Waltenberger · Wolfgang Waltenberger
GPU acceleration of a petascale application for turbulent mixing at high Schmidt number using OpenMP 4.5 T. Hammerschmidt · T. Hammerschmidt · B. Seiser · B. Seiser · M. E. Ford · M. E. Ford · A.N. Ladines · S. Schreiber · N. Wang · J. Jenke · Y. Lysogorskiy · Carlos Teijeiro · M. Mrovec · M. Cak · Elena R. Margine · Elena R. Margine · D. G. Pettifor · R. Drautz · R. Drautz · R. Drautz
Generalized Finite-Difference Time-Domain method with absorbing boundary conditions for solving the nonlinear Schrödinger equation on a GPU Wonqook Choi · Kihyeon Cho · Insung Yeo · Insung Yeo
Influence of the confinement potential on the size-dependent optical response of metallic nanometric particles M.P. Clay · M.P. Clay · D. Buaria · P. K. Yeung · Toshiyuki Gotoh · Toshiyuki Gotoh
GPU parallel simulation algorithm of Brownian particles with excluded volume using Delaunay triangulations Toshio Fukushima · Toshio Fukushima
Faster tensor canonicalization R.J. Chen · M. Wang · X.L. Yan · Qingwei Yang · Y. H. Lam · Ling Yang · Y. H. Zhang · Y. H. Zhang
Hybrid DG/FV schemes for magnetohydrodynamics and relativistic hydrodynamics Songsong Ji · Yibo Yang · Gang Pang · Xavier Antoine · Xavier Antoine
Statistical algorithms for particle trajectography Sudipta Kundu · Satadeep Bhattacharjee · Seung-Cheol Lee · Manish Jain · Manish Jain
A multilevel-skin neighbor list algorithm for molecular dynamics simulation Tadeusz Tomczak · Roman G. Szafran · Roman G. Szafran
High-resolution method for evolving complex interface networks Andrew Fowlie · Andrew Fowlie
A high-speed tracking algorithm for dense granular media T. Shakirov · T. Shakirov
A sparse matrix–vector multiplication based algorithm for accurate density matrix computations on systems of millions of atoms Shingo Ito · Dmitri G. Fedorov · Yuko Okamoto · Stephan Irle · Stephan Irle
LIMAO: Cross-platform software for simulating laser-induced alignment and orientation dynamics of linear-, symmetric- and asymmetric tops Mauricio Cerda · Cristobal A. Navarro · Juan Jorge Silva · Scott Waitukaitis · Nicolás Mujica · Nancy Hitschfeld · Nancy Hitschfeld
A domain-decomposition method to implement electrostatic free boundary conditions in the radial direction for electric discharges Purnima Ghale · H. T. Johnson · H. T. Johnson
How to differentiate collective variables in free energy codes: Computer-algebra code generation and automatic differentiation Tamás Szidarovszky · Maho Jono · Kaoru Yamanouchi · Kaoru Yamanouchi
Slurm: Fluid particle-in-cell code for plasma modeling Alejandro Malagón-Romero · Alejandro Luque · Alejandro Luque
w2dynamics: Local one- and two-particle quantities from dynamical mean field theory Toni Giorgino · Toni Giorgino
iHixs 2 — Inclusive Higgs cross sections Vyacheslav Olshevsky · Fabio Bacchini · Stefaan Poedts · Giovanni Lapenta · Giovanni Lapenta
CFD study of fluid flow changes with erosion Markus Wallerberger · Andreas Hausoel · Patrik Gunacker · Alexander Kowalski · Nicolaus Parragh · Florian Goth · K. Held · G. Sangiovanni · G. Sangiovanni
Efficient mesoscale hydrodynamics: Multiparticle collision dynamics with massively parallel GPU acceleration Alejandro López · Matthew Stickland · William Dempster · William Dempster
Positivity-preserving scheme for two-dimensional advection-diffusion equations including mixed derivatives Peter R. Wiecha · Peter R. Wiecha
A fast C++ implementation of thermal functions Michael P. Howard · Athanassios Z. Panagiotopoulos · Arash Nikoubashman · Arash Nikoubashman
Natural orbital-based Lanczos method for Anderson impurity models E. J. Du Toit · M.R. O’Brien · R. G. L. Vann · R. G. L. Vann
Incompressible SPH (ISPH) with fast Poisson solver on a GPU Sheng Bi · Li Huang · Ning-Hua Tong · Ning-Hua Tong
Convergence estimation of flat-histogram algorithms based on simulation results Zhicong Liu · Zhicong Liu · Ji Qiang · Ji Qiang
TORBEAM 2.0, a paraxial beam tracing code for electron-cyclotron beams in fusion plasmas for extended physics applications Shucheng Pan · Xiangyu Hu · Nikolaus A. Adams · Nikolaus A. Adams
Kinetic-j: A computational kernel for solving the linearized Vlasov equation applied to calculations of the kinetic, configuration space plasma current for time harmonic wave electric fields Alex D. Chow · Benedict D. Rogers · Steven Lind · Peter Stansby · Peter Stansby
Preconditioned nonlinear conjugate gradient method for micromagnetic energy minimization E. Poli · A. Bock · M. Lochbrunner · O. Maj · M. Reich · A. Snicker · A. Snicker · A. Stegmeir · F. Volpe · N. Bertelli · R. Bilato · G. D. Conway · D. Farina · F. Felici · L. Figini · R. Fischer · C. Galperti · T. Happel · Y.R. Lin-Liu · N. B. Marushchenko · U. Mszanowski · F.M. Poli · J. Stober · E. Westerhof · R. Zille · A. G. Peeters · G. Pereverzev · G. Pereverzev
micrOMEGAs5.0 : freeze-in D.L. Green · Lee A. Berry · Adam Simpson · Timothy Younkin · Timothy Younkin · Timothy Younkin
CutLang: A Particle Physics Analysis Description Language and Runtime Interpreter Lukas Exl · Johann Fischbacher · Alexander Kovacs · Markus Gusenbauer · T. Schrefl · T. Schrefl
QSWalk.jl: Julia package for quantum stochastic walks analysis G. Belanger · F. Boudjema · Andreas Goudelis · A. Pukhov · Bryan Zaldivar · Bryan Zaldivar
Many-integrated core (MIC) technology for accelerating Monte Carlo simulation of radiation transport: A study based on the code DPM G. Unel · S. Sekmen · S. Sekmen
A comment on the article Ab initio calculations of pressure-dependence of high-order elastic constants using finite deformations approachby I. Mosyagin, A.V. Lugovskoy, O.M. Krasilnikov, Yu.Kh. Vekilov, S.I. Simak and I.A. Abrikosov [Computer Physics Communications 220 (2017) 20–30] M. Rodriguez · L. Brualla · L. Brualla
CLUMPY v3: γ-ray and ν signals from dark matter at all scales Manaschai Kunaseth · Supa Hannongbua · Aiichiro Nakano · Aiichiro Nakano
The viability of ADVANTG deterministic method for synthetic radiography generation M.J. Rutter · M.J. Rutter
Counting the number of Feynman graphs in QCD Yong Cai · Xiangyang Cui · Guangyao Li · Wenyang Liu · Wenyang Liu
Projective multiscale time-integration for electrostatic particle-in-cell methods Nicola Giuliani · Nicola Giuliani
BoltzTraP2, a program for interpolating band structures and calculating semi-classical transport coefficients T. Kaneko · T. Kaneko
Implementation of replica-exchange umbrella sampling in GAMESS Nathan P. Walter · Abhishek Jaiswal · Zhikun Cai · Yang Zhang · Yang Zhang
LiquidLib: A comprehensive toolbox for analyzing classical and ab initio molecular dynamics simulations of liquids and liquid-like matter with applications to neutron scattering experiments Florian Benedetti · Claire Loison · Claire Loison
DeePMD-kit: A deep learning package for many-body potential energy representation and molecular dynamics Daniel Winkler · Massoud Rezavand · Wolfgang Rauch · Wolfgang Rauch
A modified dual-level fast multipole boundary element method for large-scale three-dimensional potential problems Aleksander Jablonski · Aleksander Jablonski
A library for wall-modelled large-eddy simulation based on OpenFOAM technology Xiaofeng Yang · Xiaofeng Yang · Jia Zhao · Jia Zhao
PySCF-NAO: An efficient and flexible implementation of linear response time-dependent density functional theory with numerical atomic orbitals Jiaxiang Cai · Yushun Wang · Chaolong Jiang · Chaolong Jiang
i-PI 2.0: A universal force engine for advanced molecular simulations P. Koval · P. Koval · Marc Barbry · Marc Barbry · Daniel Sánchez-Portal · Daniel Sánchez-Portal · Daniel Sánchez-Portal
Implementation of a gyrokinetic collision operator with an implicit time integration scheme and its computational performance Timofey Mukha · Saleh Rezaeiravesh · Mattias Liefvendahl · Mattias Liefvendahl
Efficient linear schemes for the nonlocal Cahn–Hilliard equation of phase field models Mauro Del Ben · Felipe H. da Jornada · Felipe H. da Jornada · Andrew Canning · Nathan Wichmann · Karthik Raman · Ruchira Sasanka · Chao Yang · Steven G. Louie · Steven G. Louie · Jack Deslippe · Jack Deslippe
Some useful optimisations for unstructured computational fluid dynamics codes on multicore and manycore architectures Venkat Kapil · Mariana Rossi · Ondrej Marsalek · Riccardo Petraglia · Yair Litman · Thomas Spura · Bingqing Cheng · Alice Cuzzocrea · Robert Horst Meißner · David M. Wilkins · Przemyslaw Juda · Sébastien P. Bienvenue · Wei Fang · Jan Kessler · Igor Poltavsky · Steven Vandenbrande · Jelle Wieme · Clémence Corminboeuf · Thomas D. Kühne · David E. Manolopoulos · Thomas E. Markland · Jeremy O. Richardson · Alexandre Tkatchenko · Gareth A. Tribello · Veronique Van Speybroeck · Michele Ceriotti · Michele Ceriotti
Large-scale ab initio simulations for periodic system Shinya Maeyama · T.-H. Watanabe · Yasuhiro Idomura · Motoki Nakata · Masanori Nunami · Masanori Nunami
Implementation of the replica-exchange Wang–Landau sampling on Graphics Processing Units (GPUs) Ioan Hadade · Ioan Hadade · Feng Wang · Mauro Carnevale · Luca di Mare · Luca di Mare
The Chandrasekhar function for modeling photoelectron transport in solids Xuecheng Shao · Qiang Xu · Sheng Wang · Jian Lv · Yanchao Wang · Yanming Ma · Yanming Ma
Local structure-preserving algorithms for general multi-symplectic Hamiltonian PDEs Daniel Winkler · Massoud Rezavand · Massoud Rezavand · Michael Meister · Wolfgang Rauch · Wolfgang Rauch
Decoupled, energy stable schemes for a phase-field surfactant model A. Boer · A. Boer
Large-scale GW calculations on pre-exascale HPC systems Yao-Lung L. Fang · Yao-Lung L. Fang
gpuSPHASE—A shared memory caching implementation for 2D SPH using CUDA (new version announcement) O.P. Shemyakin · P.R. Levashov · P.A. Krasnova · P.A. Krasnova
FDTD: Solving 1+1D delay PDE in parallel Debasmita Samaddar · D. Coster · X. Bonnin · Lee A. Berry · Wael R. Elwasif · D. B. Batchelor · D. B. Batchelor
Symplectic multi-particle tracking on GPUs Mihail Nedjalkov · Paul Ellinghaus · Josef Weinbub · Toufik Sadi · Toufik Sadi · Asen Asenov · Ivan Dimov · Siegfried Selberherr · Siegfried Selberherr
Comparative study of the effectiveness of PROOF with other parallelization methods implemented in the ROOT software package Guangpu Zhu · Jisheng Kou · Shuyu Sun · Jun Yao · Aifen Li · Aifen Li
TFmix: A high-precision implementation of the finite-temperature Thomas–Fermi model for a mixture of atoms Bogdan Tanygin · Bogdan Tanygin
Application of the parareal algorithm to simulations of ELMs in ITER plasma Nico Sanna · G. Morelli · S. Orlandini · I. Baccarelli · I. Baccarelli
Langevin dynamics simulation with dipole–dipole interactions: Massive performance improvements and advanced analytical integrator Olga Shapoval · Jean-Luc Vay · Henri Vincenti · Henri Vincenti
VOLSCAT2.0: The new version of the package for electron and positron scattering off molecular targets Matteo Patriarca · Patricio Farrell · Jürgen Fuhrmann · Thomas Koprucki · Thomas Koprucki
Two-step perfectly matched layer for arbitrary-order pseudo-spectral analytical time-domain methods Robert Searles · Sunita Chandrasekaran · Wayne Joubert · Oscar R. Hernandez · Oscar R. Hernandez
Highly accurate quadrature-based Scharfetter-Gummel schemes for charge transport in degenerate semiconductors Pavel V. Bushlanov · Vladislav A. Blatov · Artem R. Oganov · Artem R. Oganov
JOZSO, a computer code for calculating broad neutron resonances in phenomenological nuclear potentials Junpu Li · Junpu Li · Wen Chen · Qing Hua Qin · Zhuo-Jia Fu · Zhuo-Jia Fu
MPI + OpenACC: Accelerating radiation transport mini-application, minisweep, on heterogeneous systems Zongrui Pei · Markus Eisenbach · Sai Mu · G. Malcolm Stocks · G. Malcolm Stocks
Topology-based crystal structure generator Moritz Hütten · Céline Combet · David Maurin · David Maurin
Error controlling of the combined Cluster-Expansion and Wang-Landau Monte-Carlo method and its application to FeCo Paul Cazeaux · Jan S. Hesthaven · Jan S. Hesthaven
Stochastic analysis of surface roughness models in quantum wires T.M. Solovjeva · A.G. Soloviev · A.G. Soloviev
Comment to:Martini straight: Boosting performance using a shorter cutoff and GPUsby D.H. de Jong, S. Baoukina, H.I. Ingólfsson, and S.J. Marrink Á. Baran · Cs. Noszály · T. Vertse · T. Vertse
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RPYFMM: Parallel adaptive fast multipole method for Rotne–Prager–Yamakawa tensor in biomolecular hydrodynamics simulations Diego Gonzalez-Herrero · Elisabetta Boella · Giovanni Lapenta · Giovanni Lapenta
Enabling rootless Linux Containers in multi-user environments: The udocker tool D. G. Green · D. G. Green
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VOFTools - A software package of calculation tools for volume of fluid methods using general convex grids J. R. King · I. V. Pogorelov · K. M. Amyx · M. Borland · R. Soliday · R. Soliday
Multi-architecture Monte-Carlo (MC) simulation of soft coarse-grained polymeric materials: SOft coarse grained Monte-Carlo Acceleration (SOMA) Luis Vela Vela · Raul Sanchez · J. Geiger · J. Geiger
The PseudoDojo: Training and grading a 85 element optimized norm-conserving pseudopotential table Haram Yeo · Hyungson Ki · Hyungson Ki
Pushing memory bandwidth limitations through efficient implementations of Block-Krylov space solvers on GPUs Ludwig Schneider · Marcus Müller · Marcus Müller
Equilibrium reconstruction in an iron core tokamak using a deterministic magnetisation model M.J. Van Setten · Matteo Giantomassi · Eric Bousquet · Matthieu Verstraete · Don R. Hamann · Xavier Gonze · Gian-Marco Rignanese · Gian-Marco Rignanese
Histogram-free multicanonical Monte Carlo sampling to calculate the density of states Ioannis G. Tsoulos · O.T. Kosmas · V.N. Stavrou · V.N. Stavrou
An iterative algorithm of coupling the Kinetic Code for Plasma Periphery (KIPP) with SOLPS Bernd A. Berg · Bernd A. Berg
An improved cascaded SO-FDTD method for high temperature magnetized plasma Menglong Zhao · A. V. Chankin · D. Coster · D. Coster
Velocity-gauge real-time TDDFT within a numerical atomic orbital basis set Matthew Stein · Matthew Stein
Accelerating lattice QCD simulations with 2 flavors of staggered fermions on multiple GPUs using OpenACC—A first attempt Mohammad Javadi · Yaser Abdi · Yaser Abdi
NASAL-Geom, a free upper respiratory tract 3D model reconstruction software C. D. Pemmaraju · Fernando D. Vila · Joshua J. Kas · Shunsuke A. Sato · J. J. Rehr · Kazuhiro Yabana · David Prendergast · David Prendergast
Conformational Space Annealing explained: A general optimization algorithm, with diverse applications Sourendu Gupta · Pushan Majumdar · Pushan Majumdar
Recent developments in bound-state calculations using the Dyson–Schwinger and Bethe–Salpeter equations Jose L. Cercos-Pita · I. R. Cal · Daniel Duque · G. Sanjuán de Moreta · G. Sanjuán de Moreta
GPU acceleration and performance of the particle-beam-dynamics code Elegant Grigorios P. Zouros · Grigorios P. Zouros
mVMC—Open-source software for many-variable variational Monte Carlo method Han Wang · Linfeng Zhang · Jiequn Han · Weinan E · Weinan E
MatchingTools: A Python library for symbolic effective field theory calculations Peng Zhang · Peng Zhang · Hyunsuk Lee · Deokjung Lee · Deokjung Lee
CCOMP: An efficient algorithm for complex roots computation of determinantal equations Xianglin Liu · Yang Wang · Markus Eisenbach · G. Malcolm Stocks · G. Malcolm Stocks
On the Transfer Matrix of the Modified Power Method Helios Sanchis-Alepuz · Richard Williams · Richard Williams
An efficient GPU algorithm for tetrahedron-based Brillouin-zone integration Craig White · Matthew K. Borg · Thomas Scanlon · Stephen M. Longshaw · Benzi John · David R. Emerson · Jason M. Reese · Jason M. Reese
DiracSolver: A tool for solving the Dirac equation F. Orts · G. Ortega · Ester M. Garzón · A.M. Puertas · A.M. Puertas
anQCD: A Mathematica package for calculations in general analytic QCD models (new version announcement) Stephen M. Longshaw · Matthew K. Borg · Srinivasa Babu Ramisetti · Jun Zhang · Duncan A. Lockerby · David R. Emerson · Jason M. Reese · Jason M. Reese
A two-stage fourth-order gas-kinetic scheme on unstructured hybrid mesh S. Odaka · Y. Kurihara · Y. Kurihara
DIAPHANE: a portable radiation transport library for astrophysical applications Deep Raj Meena · Shridhar R. Gadre · P. Balanarayan · P. Balanarayan
BlackNUFFT: Modular customizable black box hybrid parallelization of type 3 NUFFT in 3D César Ayala · Gorazd Cvetic · Gorazd Cvetic
Compression of Wannier functions into Gaussian-type orbitals Kieran S. Austin · Martin Marenz · Wolfhard Janke · Wolfhard Janke
A new GPU implementation for lattice-Boltzmann simulations on sparse geometries Daniel Guterding · Harald O. Jeschke · Harald O. Jeschke
Rings: An efficient Java/Scala library for polynomial rings Pengnan Sun · A. Colagrossi · Salvatore Marrone · Matteo Antuono · A.M. Zhang · A.M. Zhang
A Hybridizable Discontinuous Galerkin solver for the Grad–Shafranov equation Huabin Shi · Xiping Yu · Robert A. Dalrymple · Robert A. Dalrymple
[email protected] 2.9: Radiation matching for simulating photon production processes in hadron collisions Xingjie Peng · Pablo Ducru · Shichang Liu · Benoit Forget · Jingang Liang · Kord Smith · Kord Smith
A GPU Poisson-Fermi solver for ion channel simulations Jason Aebischer · Ilaria Brivio · Alejandro Celis · Jared A. Evans · Yun Jiang · Jacky Kumar · Xuanyou Pan · Werner Porod · Janusz Rosiek · David Shih · Florian Staub · David M. Straub · Danny van Dyk · Avelino Vicente · Avelino Vicente
WCxf: an exchange format for Wilson coefficients beyond the Standard Model Stanislav Poslavsky · Stanislav Poslavsky
A particle localization algorithm on unstructured curvilinear polynomial meshes Elias Assmann · Elias Assmann · Philipp Wissgott · Jan Kuneš · A. Toschi · Peter Blaha · K. Held · K. Held
Calculation of orbital fractional parentage coefficients for five particles in translationally invariant basis Alfred C.K. Farris · Ying Wai Li · Markus Eisenbach · Markus Eisenbach
Performance evaluation of CMFD on inter-cycle correlation reduction of Monte Carlo simulation Jian-Xiao Liu · Lu Ju · Peng Du · Yu-Jie Liu · Hong-Wei Yang · Hong-Wei Yang
LAURA$^{++}$: A Dalitz plot fitter Maoyuan Wang · Maoyuan Wang · Gui-Bin Liu · Hong Guo · Yugui Yao · Yugui Yao
FeynHelpers: Connecting FeynCalc to FIRE and Package-X Trung Dac Nguyen · Trung Dac Nguyen · Trung Dac Nguyen
X-ray diffraction data-assisted structure searches Alexey E. Nazarov · Roman G. Fedunov · Anatoly I. Ivanov · Anatoly I. Ivanov
Adaptive particle–cell algorithm for Fokker–Planck based rarefied gas flow simulations Daniel Dercks · Daniel Dercks · Nishita Desai · Jong Soo Kim · Krzysztof Rolbiecki · Jamie Tattersall · Torsten Weber · Torsten Weber
Development of 2D implicit particle simulation code for ohmic breakdown physics in a tokamak Vladyslav Shtabovenko · Vladyslav Shtabovenko
PCTDSE: A parallel Cartesian-grid-based TDSE solver for modeling laser-atom interactions Mohammad Mehdi Rashidi · Mohammad Mehdi Rashidi
Massively parallel and linear-scaling algorithm for second-order Møller–Plesset perturbation theory applied to the study of supramolecular wires Pengyue Gao · Qunchao Tong · Jian Lv · Yanchao Wang · Yanming Ma · Yanming Ma
GPU-accelerated red blood cells simulations with transport dissipative particle dynamics M. Pfeiffer · M.H. Gorji · M.H. Gorji
GPU-accelerated Tersoff potentials for massively parallel Molecular Dynamics simulations Wenjie Jin · J. Ruud van Ommen · Chris R. Kleijn · Chris R. Kleijn
Corrigendum toThe modified differential transform method for solving MHD boundary-layer equations[Comput. Phys. Comm. 180 (2009) 2210–2217] Asaf Farhi · Bipin Singh · Bipin Singh
A novel method for calculating relative free energy of similar molecules in two environments S.J. Eder · D. Bianchi · U. Cihak-Bayr · K. Gkagkas · K. Gkagkas
RandSpg: an open-source program for generating atomistic crystal structures with specific spacegroups Hakan Başağaoğlu · Justin Blount · Jarred Blount · Bryant Nelson · Sauro Succi · Phil M. Westhart · John R. Harwell · John R. Harwell
Methods for atomistic abrasion simulations of laterally periodic polycrystalline substrates with fractal surfaces Ansel L. Blumers · Yu-Hang Tang · Zhen Li · Xuejin Li · George Em Karniadakis · George Em Karniadakis
A new cut-cell algorithm for DSMC simulations of rarefied gas flows around immersed moving objects Danny Broberg · Danny Broberg · Bharat Medasani · Bharat Medasani · Nils E. R. Zimmermann · Guodong Yu · Andrew Canning · Maciej Haranczyk · Mark Asta · Mark Asta · Geoffroy Hautier · Geoffroy Hautier
Dynamic Analysis Environment for Nuclear Forensic Analyses Patrick Avery · Eva Zurek · Eva Zurek
Azurite : An algebraic geometry based package for finding bases of loop integrals Shaolin Liu · Dinghui Yang · Chao Lang · Wenshuai Wang · Zhide Pan · Zhide Pan
GPU-accelerated algorithms for many-particle continuous-time quantum walks P. A. Muñoz · P. A. Muñoz · N. Jain · N. Jain · Patrick Kilian · J. Büchner · J. Büchner · J. Büchner
Density of optical states in rolled-up photonic crystals and quasi crystals☆ Alessandro Georgoudis · Alessandro Georgoudis · Kasper J. Larsen · Kasper J. Larsen · Yang Zhang · Yang Zhang
Cucheb: A GPU implementation of the filtered Lanczos procedure Dor Gabay · Xueyang Wang · Vitaly Lomakin · Amir Boag · Manish Jain · Amir Natan · Amir Natan
QmeQ 1.0: An open-source Python package for calculations of transport through quantum dot devices Sebastian Krämer · David Plankensteiner · Laurin Ostermann · Helmut Ritsch · Helmut Ritsch
RCCPAC: A parallel relativistic coupled-cluster program for closed-shell and one-valence atoms and ions in FORTRAN ☆ Enrico Piccinini · Claudia Benedetti · Ilaria Siloi · Matteo G. A. Paris · Paolo Bordone · Paolo Bordone
Space–time adaptive ADER-DG schemes for dissipative flows: Compressible Navier–Stokes and resistive MHD equations Jakub Benda · Karel Houfek · Karel Houfek
An energy-dependent numerical model for the condensation probability, γj B. K. Mani · Siddhartha Chattopadhyay · D. Angom · D. Angom
dugksFoam: An open source OpenFOAM solver for the Boltzmann model equation Arya Fallahi · Alireza Yahaghi · Franz X. Kärtner · Franz X. Kärtner
ms2: A molecular simulation tool for thermodynamic properties, release 3.0 Yongsheng Fu · Jiaolong Zeng · Jiaolong Zeng · Jianmin Yuan · Jianmin Yuan · Jianmin Yuan
A new hybrid code (CHIEF) implementing the inertial electron fluid equation without approximation Hakan Başağaoğlu · John R. Harwell · Hoa Nguyen · Sauro Succi · Sauro Succi
High-performance GPU parallel solver for 3D modeling of electron transfer during ion–surface interaction Julian Lee · Julian Lee
Lennard-Jones type pair-potential method for coarse-grained lipid bilayer membrane simulations in LAMMPS Juha Javanainen · Juha Javanainen
Unsteady open boundaries for SPH using semi-analytical conditions and Riemann solver in 2D I.K. Gainullin · I.K. Gainullin
Principals of simulation of ultrafast charge transfer in solution within the multichannel stochastic point-transition model S.-P. Fu · Zhangli Peng · Hongyan Yuan · R. Kfoury · Yuan-Nan Young · Yuan-Nan Young
Reducing the dimensionality of grid based methods for electron-atom scattering calculations below ionization threshold Lianhua Zhu · Songze Chen · Zhaoli Guo · Zhaoli Guo
Enhanced computational performance of the lattice Boltzmann model for simulating micron- and submicron-size particle flows and non-Newtonian fluid flows Ehsan Saei Ghareh Naz · Matthew R. Jorgensen · Oliver G. Schmidt · Oliver G. Schmidt
gpuSPHASE—A shared memory caching implementation for 2D SPH using CUDA C.L. Stork · C.C. Ummel · D.S. Stuart · S. Bodily · B.L. Goldblum · B.L. Goldblum
CheckMATE 2: From the model to the limit Martin Ferrand · Antoine Joly · Christophe Kassiotis · Damien Violeau · Agnès Leroy · François-Xavier Morel · Benedict D. Rogers · Benedict D. Rogers
The Software Atom Leslie M. Kerby · Leslie M. Kerby · Leslie M. Kerby
Temporal parallelization of edge plasma simulations using the parareal algorithm and the SOLPS code Zi He · Ru-Shan Chen · Ru-Shan Chen
ElecSus : extension to arbitrary geometry magneto-optics Min-Gu Yoo · Jeong Won Lee · Young Gi Kim · Yong-Su Na · Yong-Su Na
DynaPhoPy: A code for extracting phonon quasiparticles from molecular dynamics simulations Gábor Rutkai · Andreas Köster · Gabriela Guevara-Carrion · Tatjana Janzen · Michael Schappals · Colin W. Glass · Martin Bernreuther · Amer Wafai · Simon Stephan · Maximilian Kohns · Steffen Reiser · Stephan Deublein · Martin Horsch · Hans Hasse · Jadran Vrabec · Jadran Vrabec
Paradeisos: A perfect hashing algorithm for many-body eigenvalue problems David Regnier · N. Dubray · M. Verrière · Nicolas Schunck · Nicolas Schunck
An energy stable algorithm for a quasi-incompressible hydrodynamic phase-field model of viscous fluid mixtures with variable densities and viscosities Ferenc Karsai · Fabien Tran · Peter Blaha · Peter Blaha
FELIX-2.0: New version of the finite element solver for the time dependent generator coordinate method with the Gaussian overlap approximation Xinmin Ge · Hua Chen · Yiren Fan · Juntao Liu · Jianchao Cai · Jianyu Liu · Jianyu Liu
On the importance of local orbitals using second energy derivatives for d and f electrons Alain Marx · Hinrich Lütjens · Hinrich Lütjens
An improved pulse sequence and inversion algorithm of T2 spectrum Michelangelo Preti · Michelangelo Preti
Hybrid parallelization of the XTOR-2F code for the simulation of two-fluid MHD instabilities in tokamaks Willem Deconinck · Peter Bauer · Michail Diamantakis · Mats Hamrud · Christian Kühnlein · Pedro Maciel · Gianmarco Mengaldo · Tiago Quintino · Baudouin Raoult · Piotr K. Smolarkiewicz · Nils P. Wedi · Nils P. Wedi
Computational performance of SequenceL coding of the lattice Boltzmann method for multi-particle flow simulations Hemanadhan Myneni · Mark E. Casida · Mark E. Casida
WiLE: A Mathematica package for weak coupling expansion of Wilson loops in ABJ(M) theory Sergio Blanes · Fernando Casas · Mechthild Thalhammer · Mechthild Thalhammer
Atlas : A library for numerical weather prediction and climate modelling Burkhard Schmidt · Carsten Hartmann · Carsten Hartmann
High-order commutator-free quasi-Magnus exponential integrators for non-autonomous linear evolution equations Wanyok Atisattapong · Pasin Marupanthorn · Pasin Marupanthorn
A 1/t algorithm with the density of two states for estimating multidimensional integrals Haruhiko Kohno · J.R. Myra · J.R. Myra
A hybrid algorithm for parallel molecular dynamics simulations Alireza Javidi Shirvan · Isabelle Choquet · Håkan Nilsson · Hrvoje Jasak · Hrvoje Jasak
Efficient method to calculate the electron–phonon coupling constant and superconducting transition temperature F. Volpe · Pierre-David Létourneau · A. Zhao · A. Zhao
Three-dimensional implementation of the Low Diffusion method for continuum flow simulations Chris M. Mangiardi · Ralf Meyer · Ralf Meyer
Kubo–Greenwood electrical conductivity formulation and implementation for projector augmented wave datasets Debasmita Samaddar · D. Coster · X. Bonnin · X. Bonnin · Christoph Bergmeister · E. Havlíc̆ková · Lee A. Berry · Wael R. Elwasif · D. B. Batchelor · D. B. Batchelor
The LDA-1/2 method implemented in the exciting code A. Mirza · P. Nizenkov · M. Pfeiffer · Stefanos Fasoulas · Stefanos Fasoulas
Frequency-domain and time-domain solvers of parabolic equation for rotationally symmetric geometries Henri Vincenti · Henri Vincenti · Jean-Luc Vay · Jean-Luc Vay
A finite element procedure for radio-frequency sheath–plasma interactions based on a sheath impedance model Sheng-Chun Yang · Zhong-Yuan Lu · Hu-Jun Qian · Yong-Lei Wang · Jie-Ping Han · Jie-Ping Han
A hybrid parallel architecture for electrostatic interactions in the simulation of dissipative particle dynamics Ronaldo Rodrigues Pela · Ronaldo Rodrigues Pela · Andris Gulans · Claudia Draxl · Claudia Draxl
Studying the varied shapes of gold clusters by an elegant optimization algorithm that hybridizes the density functional tight-binding theory and the density functional theory Yuezheng Gong · Jia Zhao · Jia Zhao · Qi Wang · Qi Wang · Qi Wang
New fast accurately conservative scheme for solving numerically the time-dependent isotropic Fokker–Planck equation Chunjing Jia · Y. Wang · Y. Wang · Christian B. Mendl · Brian Moritz · Brian Moritz · T. P. Devereaux · T. P. Devereaux · T. P. Devereaux
Computational performance of simple and efficient sequential and parallel Dirac equation solvers Tsung-Wen Yen · Thong Leng Lim · Tiem Leong Yoon · S. K. Lai · S. K. Lai
A derivation and scalable implementation of the synchronous parallel kinetic Monte Carlo method for simulating long-time dynamics P. C. Bhat · Harrison Prosper · S. Sekmen · Chip Stewart · Chip Stewart
Development of a coupled level set and immersed boundary method for predicting dam break flows James Keaveney · C. S. Adams · Ifan G. Hughes · Ifan G. Hughes
Equilibrium Spline Interface ( ESI) for magnetic confinement codes Abel Carreras · Atsushi Togo · Isao Tanaka · Isao Tanaka
Size dependent electronic properties of silicon quantum dots—An analysis with hybrid, screened hybrid and local density functional theory Hye Suk Byun · Mohamed Y. El-Naggar · Rajiv K. Kalia · Aiichiro Nakano · Priya Vashishta · Priya Vashishta
Celeris: A GPU-accelerated open source software with a Boussinesq-type wave solver for real-time interactive simulation and visualization C.H. Yu · Tony W. H. Sheu · Tony W. H. Sheu
A parallel algorithm for Hamiltonian matrix construction in electron–molecule collision calculations: MPI-SCATCI Xujing Li · L. Zakharov · L. Zakharov
Dynamic greedy algorithms for the Edwards–Anderson model Fabrice Deluzet · Maurizio Ottaviani · Stefan Possanner · Stefan Possanner
Two-way coupling of magnetohydrodynamic simulations with embedded particle-in-cell simulations Sasan Tavakkol · Patrick J. Lynett · Patrick J. Lynett
OpenMP GNU and Intel Fortran programs for solving the time-dependent Gross-Pitaevskii equation Ahmed F. Al-Refaie · Jonathan Tennyson · Jonathan Tennyson
Benchmark of multi-phase method for the computation of fast ion distributions in a tokamak plasma in the presence of low-amplitude resonant MHD activity Kirit Makwana · Rony Keppens · Giovanni Lapenta · Giovanni Lapenta
A Drift-Asymptotic scheme for a fluid description of plasmas in strong magnetic fields Xavier Antoine · Emmanuel Lorin · Emmanuel Lorin · Emmanuel Lorin
Efficient combination of acceleration techniques applied to high frequency methods for solving radiation and scattering problems E Luis Young-S. · P. Muruganandam · Sadhan K. Adhikari · Vladimir Lončar · Dušan Vudragović · Antun Balaž · Antun Balaž
Diagonalization of complex symmetric matrices: Generalized Householder reflections, iterative deflation and implicit shifts A. Bierwage · Y. Todo · Y. Todo
High-order integration scheme for relativistic charged particle motion in magnetized plasmas with volume preserving properties Lorena Lozano · María Jesús Algar · Eliseo Garcia · Iván González · Felipe Cátedra · Felipe Cátedra
AELAS: Automatic ELAStic property derivations via high-throughput first-principles computation J. H. Noble · M. Lubasch · J. Stevens · Ulrich D. Jentschura · Ulrich D. Jentschura
Single-step reinitialization and extending algorithms for level-set based multi-phase flow simulations Akinobu Matsuyama · M. Furukawa · M. Furukawa
MaMiCo: Transient multi-instance molecular-continuum flow simulation on supercomputers S.H. Zhang · R.F. Zhang · R.F. Zhang
PFMCal : Photonic force microscopy calibration extended for its application in high-frequency microrheology Lin Fu · Xiangyu Hu · Nikolaus A. Adams · Nikolaus A. Adams
Huygens–Fresnel wavefront tracing Alberto García · Matthieu Verstraete · Yann Pouillon · Javier Junquera · Javier Junquera
Modified symplectic schemes with nearly-analytic discrete operators for acoustic wave simulations Zhong-Li Liu · Rui Li · Xiu-Lu Zhang · Nuo Qu · Ling-Cang Cai · Ling-Cang Cai
Mie calculation of electromagnetic near-field for a multilayered sphere Martin Sprengel · Alfio Borzì · Alfio Borzì
Direct anharmonic correction method by molecular dynamics Jin Myung Park · M. Murakami · H.E. St. John · Lang L. Lao · M. S. Chu · R. Prater · R. Prater
Converting point-wise nuclear cross sections to pole representation using regularized vector fitting Athmane Bakhta · Eric Cancès · Paul Cazeaux · Shiang Fang · Efthimios Kaxiras · Efthimios Kaxiras
Efficiencies of joint non-local update moves in Monte Carlo simulations of coarse-grained polymers Ilkka Kylänpää · Esa Räsänen · Esa Räsänen
PAREMD: A parallel program for the evaluation of momentum space properties of atoms and molecules Takahiro Misawa · Satoshi Morita · Kazuyoshi Yoshimi · Mitsuaki Kawamura · Yuichi Motoyama · Kota Ido · Takahiro Ohgoe · Masatoshi Imada · Takeo Kato · Takeo Kato
Development of a two-phase SPH model for sediment laden flows Shouqing Jia · Dongsheng La · Xuelian Ma · Xuelian Ma
Numerical simulation of electromagnetic waves in Schwarzschild space–time by finite difference time domain method and Green function method Georg K. H. Madsen · Jesús Carrete · Matthieu Verstraete · Matthieu Verstraete
Neighbour lists for smoothed particle hydrodynamics on GPUs N. Mai-Duy · Nhan Phan-Thien · T. Tran-Cong · T. Tran-Cong
Imposition of physical parameters in dissipative particle dynamics Andrew Bingham · Hyoung Koo Lee · Hyoung Koo Lee
A parallel finite element procedure for contact-impact problems using edge-based smooth triangular element and GPU V I. Azarov · Alexander Kramida · M. Ya. Vokhmentsev · M. Ya. Vokhmentsev
C2x: a tool for visualisation and input preparation for Castep and other electronic structure codes Barry I. Schneider · Javier Segura · Amparo Gil · Xiaoxu Guan · Klaus Bartschat · Klaus Bartschat
IDEN2—A program for visual identification of spectral lines and energy levels in optical spectra of atoms and simple molecules Marcin Maździarz · Marcin Maździarz
A new Fortran 90 program to compute regular and irregular associated Legendre functions (new version announcement) William Dawson · Takahito Nakajima · Takahito Nakajima
FMFT: Fully Massive Four-loop Tadpoles Gediminas Kiršanskas · Jonas Nyvold Pedersen · Olov Karlström · Martin Leijnse · Andreas Wacker · Andreas Wacker
Massively parallel sparse matrix function calculations with NTPoly Adam Glos · Jarosław Adam Miszczak · Mateusz Ostaszewski · Mateusz Ostaszewski
Exploiting the chaotic behaviour of atmospheric models with reconfigurable architectures Joshua P. Wilson · Weizhong Dai · Weizhong Dai
Numerical computation of electromagnetic field for general static and axisymmetric current distribution Mario Zapata-Herrera · Angela S. Camacho · Hanz Y. Ramírez · Hanz Y. Ramírez
Phase-field simulations of crystal growth in a two-dimensional cavity flow Francis P. Russell · Peter D. Düben · Xinyu Niu · Wayne Luk · T. N. Palmer · T. N. Palmer
Massively parallel data processing for quantitative total flow imaging with optical coherence microscopy and tomography Seunggyu Lee · Yibao Li · Jaemin Shin · Junseok Kim · Junseok Kim
GPU implementation of the Rosenbluth generation method for static Monte Carlo simulations Francisco Carter · Nancy Hitschfeld · Cristobal A. Navarro · Rodrigo Soto · Rodrigo Soto
WannierTools: An open-source software package for novel topological materials Marcin Sylwestrzak · Marcin Sylwestrzak · Daniel Szlag · Daniel Szlag · Paul James Marchand · Ashwin S. Kumar · Theo Lasser · Theo Lasser
Version 3 of RunDec and CRunDec Yachong Guo · Vladimir A. Baulin · Vladimir A. Baulin
GPU accelerated population annealing algorithm QuanSheng Wu · ShengNan Zhang · Hai-Feng Song · Matthias Troyer · Alexey A. Soluyanov · Alexey A. Soluyanov · Alexey A. Soluyanov
Acceleration of the imaginary time method for spectrally computing the stationary states of Gross-Pitaevskii equations Florian Herren · Matthias Steinhauser · Matthias Steinhauser
An advanced software suite for the processing and analysis of silicon luminescence images Lev Barash · Martin Weigel · M. Borovský · Wolfhard Janke · Lev N. Shchur · Lev N. Shchur · Lev N. Shchur
Lattice dynamics calculations based on density-functional perturbation theory in real space Xavier Antoine · Christophe Besse · Romain Duboscq · Vittorio Rispoli · Vittorio Rispoli
Multi-resolution Delta-plus-SPH with tensile instability control: Towards high Reynolds number flows Darren S. Reed · Timothy Dykes · R. M. Cabezón · C. Gheller · Lucio Mayer · Lucio Mayer
Announcement for the replacement of the PACIAE 2.1 and PACIAE 2.2 series Jen-Hao Chen · Ren-Chuen Chen · Jinn-Liang Liu · Jinn-Liang Liu
On the calculation of Δ〈Sˆ2〉 for electronic excitations in time-dependent density-functional theory A. Stegmeir · O. Maj · D. Coster · K. Lackner · Markus Held · Matthias Wiesenberger · Matthias Wiesenberger
An efficient method for hybrid density functional calculation with spin–orbit coupling Dongxin Pan · Chengwen Zhong · Congshan Zhuo · Sha Liu · Sha Liu
mdFoam+: Advanced molecular dynamics in OpenFOAM J. López · J. Hernández · P. Gómez · F. Faura · F. Faura
dsmcFoam+: an OpenFOAM based direct simulation Monte Carlo solver Juan C. Criado · Juan C. Criado
A highly scalable particle tracking algorithm using partitioned global address space (PGAS) programming for extreme-scale turbulence simulations Miguel Cárdenas-Montes · Ignacio Sevilla-Noarbe · Ignacio Sevilla-Noarbe
A new conservative vector-valued Allen–Cahn equation and its fast numerical method Ulrich Hohenester · Ulrich Hohenester
Efficient block preconditioned eigensolvers for linear response time-dependent density functional theory Luigi Delle Site · Luigi Delle Site
Fully-relativistic full-potential multiple scattering theory: A pathology-free scheme InSuk Joung · Jong Yun Kim · Steven P. Gross · Steven P. Gross · Keehyoung Joo · Jooyoung Lee · Jooyoung Lee
JaSTA-2: Second version of the Java Superposition T-matrix Application Eugene Vecharynski · Jiri Brabec · Meiyue Shao · Niranjan Govind · Chao Yang · Chao Yang
Kinetic Monte Carlo simulation of single-electron multiple-trapping transport in disordered media Christian Bogner · Sophia Borowka · Thomas Hahn · Gudrun Heinrich · S. P. Jones · M. Kerner · A. von Manteuffel · M. Michel · Erik Panzer · V. Papara · V. Papara
A fast, parallel algorithm for distant-dependent calculation of crystal properties Phanish Suryanarayana · Phanisri P. Pratapa · Abhiraj Sharma · John E. Pask · John E. Pask
Loopedia, a database for loop integrals Alexander Blinne · David Schinkel · S. Kuschel · S. Kuschel · Nina Elkina · Sergey G. Rykovanov · M. Zepf · M. Zepf · M. Zepf · M. Zepf
SQDFT: Spectral Quadrature method for large-scale parallel O(N) Kohn-Sham calculations at high temperature Carsten Urbach · Carsten Urbach
A systematic approach to numerical dispersion in Maxwell solvers L. C. Appel · I. Lupelli · J. E. T. Contributors · J. E. T. Contributors
Reversibility violation in the Hybrid Monte Carlo algorithm M. A. Clark · Alexei Strelchenko · Alejandro Vaquero · Mathias Wagner · Evan Weinberg · Evan Weinberg
A unified momentum equation approach for computing thermal residual stresses during melting and solidification Xiao-Ping Zhang · Jinwu Kang · Zhipeng Guo · Shou Mei Xiong · Q. Han · Q. Han
ALARIC: An algorithm for constructing arbitrarily complex initial density distributions with low particle noise for SPH/SPMHD applications Jorge Gomes · Emanuele Bagnaschi · Isabel Campos · M. David · L.C. Alves · João Martins · João Murta Pina · Álvaro López-García · Pablo Orviz · Pablo Orviz
ANTICOOL: simulating positron cooling and annihilation in atomic gases Jorge Eduardo Macías-Díaz · Ahmed S. Hendy · Ahmed S. Hendy · R.H. De Staelen · R.H. De Staelen
A pseudo energy-invariant method for relativistic wave equations with Riesz space-fractional derivatives John P. Boyd · Paolo Amore · Francisco M. Fernández · Francisco M. Fernández
OWL: A code for the two-center shell model with spherical Woods–Saxon potentials Peter A. Boyle · Michael Chuvelev · Guido Cossu · Christopher Kelly · Christoph Lehner · Lawrence Meadows · Lawrence Meadows
Spectral algorithms for multiple scale localized eigenfunctions in infinitely long, slightly bent quantum waveguides Sergey A. Matveev · Sergey A. Matveev · Sergey A. Matveev · Vladimir I. Stadnichuk · Eugene E. Tyrtyshnikov · Eugene E. Tyrtyshnikov · A. P. Smirnov · A. P. Smirnov · N. V. Ampilogova · Nikolai V. Brilliantov · Nikolai V. Brilliantov
Accelerating HPC codes on Intel(R) Omni-Path Architecture networks: From particle physics to Machine Learning Lijie Mei · Li Huang · Li Huang
Anderson acceleration method of finding steady-state particle size distribution for a wide class of aggregation–fragmentation models John Back · Timothy Gershon · Paul Fraser Harrison · Thomas Latham · Daniel O’Hanlon · Wenbin Qian · Pablo del Amo Sanchez · D. C. Craik · J. Ilic · Juan Martin Otalora Goicochea · Eugenia Puccio · Rafael Silva Coutinho · M. Whitehead · M. Whitehead
Reliability of Lyapunov characteristic exponents computed by the two-particle method E. Boella · Gianni Coppa · A. D’Angola · B. Peiretti Paradisi · B. Peiretti Paradisi
Gridless particle technique for the Vlasov–Poisson system in problems with high degree of symmetry Yu-Liang Yan · Dai-Mei Zhou · Dai-Mei Zhou · Xu Cai · Xu Cai · Ben-Hao Sa · Ben-Hao Sa · Ben-Hao Sa
About improving efficiency of the P3M algorithms when computing the inter-particle forces in beam dynamics David Payne · Carlos Vargas · Ziv Hameiri · Stuart Wenham · D.M. Bagnall · D.M. Bagnall
Efficient determination of the Markovian time-evolution towards a steady-state of a complex open quantum system Honghui Shang · Christian Carbogno · Patrick Rinke · Patrick Rinke · Matthias Scheffler · Matthias Scheffler
A parallelization scheme of the periodic signals tracking algorithm for isochronous mass spectrometry on GPUs Alexander I. Kozynchenko · Sergey A. Kozynchenko · Sergey A. Kozynchenko
cellGPU: Massively parallel simulations of dynamic vertex models Thorsteinn H. Jonsson · Andrei Manolescu · Hsi-Sheng Goan · Nzar Rauf Abdullah · Anna Sitek · Chi-Shung Tang · Vidar Gudmundsson · Vidar Gudmundsson
ARC : an open-source library for calculating properties of alkali Rydberg atoms Paulo Nogueira · Paulo Nogueira
UmUTracker: A versatile MATLAB program for automated particle tracking of 2D light microscopy or 3D digital holography data D. Gabay · Amir Boag · Amir Natan · Amir Natan
Computational efficiency and Amdahls law for the adaptive resolution simulation technique Nikola Šibalić · J. D. Pritchard · C. S. Adams · K. J. Weatherill · K. J. Weatherill
FibrilJ: ImageJ plugin for fibrils diameter and persistence length determination Hanqing Zhang · Tim Stangner · Krister Wiklund · Alvaro Rodriguez · Magnus Andersson · Magnus Andersson
A wavelet integral collocation method for nonlinear boundary value problems in physics P.A. Sokolov · Mikhail V. Belousov · Stanislav A. Bondarev · Galina Zhouravleva · N.A. Kasyanenko · N.A. Kasyanenko
epsilon: A tool to find a canonical basis of master integrals Konsta Särkimäki · Eero Hirvijoki · Juuso Terävä · Juuso Terävä
Investigating efficient methods for computing four-quark correlation functions Lei Zhang · Jizeng Wang · Xiaojing Liu · Youhe Zhou · Youhe Zhou
Topology of molecular electron density and electrostatic potential with DAMQT Mario Prausa · Mario Prausa
Symbolic computation of equivalence transformations and parameter reduction for nonlinear physical models Abdou Abdel-Rehim · Constantia Alexandrou · Constantia Alexandrou · Joshua Berlin · Mattia Dalla Brida · Jacob Finkenrath · Marc Wagner · Marc Wagner
Exact diagonalization library for quantum electron models Alexei F. Cheviakov · Alexei F. Cheviakov
A hybrid model of laser energy deposition for multi-dimensional simulations of plasmas and metals Kasper J. Larsen · Kasper J. Larsen · Robbert Rietkerk · Robbert Rietkerk
G PU A ccelerated IN tensities MPI (GAIN-MPI): A new method of computing Einstein-A coefficients Sergei Iskakov · Sergei Iskakov · Michael Danilov · Michael Danilov · Michael Danilov
TIMEDELn: A programme for the detection and parametrization of overlapping resonances using the time-delay method Ahmed F. Al-Refaie · Sergei N. Yurchenko · Jonathan Tennyson · Jonathan Tennyson
Neural network approach for the calculation of potential coefficients in quantum mechanics Jannis Teunissen · Jannis Teunissen · Ute Ebert · Ute Ebert · Ute Ebert
Improved treatment of exact exchange in Quantum ESPRESSO Duncan A Little · Jonathan Tennyson · Martin Plummer · C.J. Noble · Andrew G. Sunderland · Andrew G. Sunderland
Efficient molecular dynamics simulations with many-body potentials on graphics processing units Sebastián Ossandón · Camilo Reyes · Patricio Cumsille · Carlos M. Reyes · Carlos M. Reyes
1D–3D coupling for hydraulic system transient simulations Taylor Barnes · Thorsten Kurth · Pierre Carrier · Nathan Wichmann · David Prendergast · Paul R. C. Kent · Jack Deslippe · Jack Deslippe
APCAD—Analysis program for the continuous-angle DSAM☆ Zheyong Fan · Zheyong Fan · Wei Chen · Ville Vierimaa · Ari Harju · Ari Harju
JDiffraction: A GPGPU-accelerated JAVA library for numerical propagation of scalar wave fields ☆ Chao Wang · Håkan Nilsson · Jiandong Yang · Olivier Petit · Olivier Petit
Fuchsia : A tool for reducing differential equations for Feynman master integrals to epsilon form ☆ Christian Stahl · J. Leske · Marc Lettmann · N. Pietralla · N. Pietralla
Space-dependent perfusion coefficient estimation in a 2D bioheat transfer problem Pablo Piedrahita-Quintero · Carlos Trujillo · Jorge Garcia-Sucerquia · Jorge Garcia-Sucerquia
Advances in the flux-coordinate independent approach Oleksandr Gituliar · Vitaly Magerya · Vitaly Magerya
An efficient transport solver for tokamak plasmas Fermín S. Viloche Bazán · Luciano Bedin · Leonardo S. Borges · Leonardo S. Borges
Optimizing kernel methods for Poisson integrals on a uniform grid Alexander Kramida · Alexander Kramida
From Feynman rules to conserved quantum numbers, I Jyotiranjan Beuria · AseshKrishna Datta · Dipsikha Debnath · K. Matchev · K. Matchev
Configuration interactions of class 11: An error in Cowans atomic structure theory Darius Germanas · A. Stepšys · S. Mickevičius · R.K. Kalinauskas · R.K. Kalinauskas
Development of a new zonal flow equation solver by diagonalisation and its application in non-circular cross-section tokamak plasmas Jae-Min Kwon · Lei Qi · S. Yi · T.S. Hahm · T.S. Hahm
Dirichlet boundary conditions for arbitrary-shaped boundaries in stellarator-like magnetic fields for the Flux-Coordinate Independent method Daniel M. Sussman · Daniel M. Sussman
The use of the edge basis function for non-conformal solution of electric current volume integral equation Benjamin E. Niehoff · Benjamin E. Niehoff
Open source Matrix Product States: Opening ways to simulate entangled many-body quantum systems in one dimension Peter Hill · Brendan William Shanahan · B. Dudson · B. Dudson
Efficient computation of turbulent flow in ribbed passages using a non-overlapping near-wall domain decomposition method Liming Zhang · Ali Deng · Minghong Wang · Xianzhu Meng · Xianzhu Meng
Adiabatic corrections for velocity-gauge simulations of electron dynamics in periodic potentials Daniel Jaschke · Michael L. Wall · Michael L. Wall · Lincoln D. Carr · Lincoln D. Carr
Hybrid multicore/vectorisation technique applied to the elastic wave equation on a staggered grid Adam Jones · Sergei Utyuzhnikov · Sergei Utyuzhnikov
Regularization with numerical extrapolation for finite and UV-divergent multi-loop integrals Sofya Titarenko · Mark Hildyard · Mark Hildyard
A high performance data parallel tensor contraction framework: Application to coupled electro-mechanics Antonio Arbona · Borja Miñano · A. Rigo · Carles Bona · Carlos Palenzuela · Antoni Artigues · Carles Bona-Casas · Joan Masso · Joan Masso
ITG–TEM turbulence simulation with bounce-averaged kinetic electrons in tokamak geometry E. de Doncker · Fukuko Yuasa · K. Kato · T. Ishikawa · John A. Kapenga · O Olagbemi · O Olagbemi
A resilient domain decomposition polynomial chaos solver for uncertain elliptic PDEs Roman Poya · Roman Poya · Antonio J. Gil · Rogelio Ortigosa · Rogelio Ortigosa
Alternative predictors in chaotic time series Paul Mycek · Andres A. Contreras · Olivier P. Le Maître · Khachik Sargsyan · Francesco Rizzi · Karla Morris · Cosmin Safta · Bert J. Debusschere · Omar M. Knio · Omar M. Knio
HOTB update: Parallel code for calculation of three- and four-particle harmonic oscillator transformation brackets and their matrices using OpenMP Konstantin Ladutenko · U. Pal · Antonio Rivera · Ovidio Peña-Rodríguez · Ovidio Peña-Rodríguez
An improved dissipative coupling scheme for a system of Molecular Dynamics particles interacting with a Lattice Boltzmann fluid Kevin Obrejan · Kenji Imadera · Jiquan Li · Yasuaki Kishimoto · Yasuaki Kishimoto
Block-structured grids in full velocity space for Eulerian gyrokinetic simulations P.R.L. Alves · L.G.S. Duarte · L.A.C.P. da Mota · L.A.C.P. da Mota
RapidSim: An application for the fast simulation of heavy-quark hadron decays☆ Nikita Tretyakov · Burkhard Dünweg · Burkhard Dünweg · Burkhard Dünweg
Convergence of Stochastic Approximation Monte Carlo and modified Wang–Landau algorithms: Tests for the Ising model D. Jarema · Hans-Joachim Bungartz · T. Görler · F. Jenko · Tobias Neckel · D. Told · D. Told
Parallel multiphase field simulations with OpenPhase Greig Cowan · D. C. Craik · M. Needham · M. Needham
Acceleration of the Particle Swarm Optimization for Peierls–Nabarro modeling of dislocations in conventional and high-entropy alloys Simon Schneider · Marco Mueller · Wolfhard Janke · Wolfhard Janke
A COKOSNUT code for the control of the time-dependent Kohn–Sham model Marvin Tegeler · Oleg Shchyglo · Reza Darvishi Kamachali · Alexander Monas · Ingo Steinbach · Godehard Sutmann · Godehard Sutmann · Godehard Sutmann
PHAST: Protein-like heteropolymer analysis by statistical thermodynamics Zongrui Pei · Zongrui Pei · Markus Eisenbach · Markus Eisenbach
SoAx: A generic C++ Structure of Arrays for handling Particles in HPC Codes Chenglong Zhang · Mingcan Zhao · Chaofeng Hou · Wei Ge · Wei Ge
SYVA: A program to analyze symmetry of molecules based on vector algebra Rafael B. Frigori · Rafael B. Frigori
Massively parallel microscopic particle-in-cell Jared L. Aurentz · Vassilis Kalantzis · Yousef Saad · Yousef Saad
A parallelization method for time periodic steady state in simulation of radio frequency sheath dynamics Igor Mosyagin · Igor Mosyagin · A.V. Lugovskoy · O.M. Krasilnikov · Yu.Kh. Vekilov · Sergey Simak · Igor A. Abrikosov · Igor A. Abrikosov
Massively parallel multicanonical simulations Graeme Bart · Christian Peltz · Nicolas Bigaouette · Thomas Fennel · Thomas Brabec · Charles Varin · Charles Varin
Efficient computation of Laguerre polynomials Åsmund Ervik · Guadalupe Jiménez Serratos · Erich A. Müller · Erich A. Müller
On reweighting for twisted boundary conditions Igor Sitnik · Igor Sitnik
High-Temperature Series Expansion for Spin-1/2 Heisenberg Models Andrea Bussone · Michele Della Morte · Martin Rasmus Lundquist Hansen · Claudio Pica · Claudio Pica
A partially mesh-free scheme for representing anisotropic spatial variations along field lines Andreas Hehn · Natalija van Well · Matthias Troyer · Matthias Troyer
Massively parallel simulations of relativistic fluid dynamics on graphics processing units with CUDA R.F. Zhang · S.H. Zhang · Z.J. He · J. Jing · S.H. Sheng · S.H. Sheng
MaMR: High-performance MapReduce programming model for material cloud applications Dennis Bazow · Ulrich Heinz · Michael Strickland · Michael Strickland
Improvements on non-equilibrium and transport Green function techniques: The next-generation transiesta Meiyue Shao · H. Metin Aktulga · Chao Yang · Esmond G. Ng · Pieter Maris · James P. Vary · James P. Vary
FEMSIM + HRMC: Simulation of and structural refinement using fluctuation electron microscopy for amorphous materials Bernd A. Berg · Bernd A. Berg
Kernel optimization for short-range molecular dynamics Jason J. Maldonis · Jinwoo Hwang · Paul M. Voyles · Paul M. Voyles
Numerical implementation of the multiscale and averaging methods for quasi periodic systems Changjun Hu · Xianmeng Wang · Jianjiang Li · Xinfu He · Shigang Li · Yangde Feng · Shaofeng Yang · He Bai · He Bai
STARlight: A Monte Carlo simulation program for ultra-peripheral collisions of relativistic ions Marco Berardi · Andrea Andrisani · Luciano Lopez · Michele Vurro · Michele Vurro
NORSE: A solver for the relativistic non-linear Fokker-Planck equation for electrons in a homogeneous plasma Ren-Chuen Chen · Chun-Hsien Li · Jinn-Liang Liu · Jinn-Liang Liu
GPU implementation of the linear scaling three dimensional fragment method for large scale electronic structure calculations Krzysztof Pachucki · M. Zientkiewicz · V. A. Yerokhin · V. A. Yerokhin
Enhanced calculation of eigen-stress field and elastic energy in atomistic interdiffusion of alloys Weile Jia · Jue Wang · Xuebin Chi · Lin-Wang Wang · Lin-Wang Wang
Crystal MD: The massively parallel molecular dynamics software for metal with BCC structure P.R.L. Alves · L.G.S. Duarte · L.A.C.P. da Mota · L.A.C.P. da Mota
Molecular dynamics simulation and first principles calculations of radiation-induced Cu clusters in Fe-3 at.% Cu alloy L. J. Titus · A. Ross · F. M. Nunes · F. M. Nunes
FOXTAIL : Modeling the nonlinear interaction between Alfven eigenmodes and energetic particles in tokamaks M. Honda · A. Fukuyama · A. Fukuyama
raaSAFT: A framework enabling coarse-grained molecular dynamics simulations based on the SAFT-γ Mie force field Taylor Haar · Waseem Kamleh · J. M. Zanotti · Y. Nakamura · Y. Nakamura
ManeParse: A Mathematica reader for Parton Distribution Functions Lukas Einkemmer · Lukas Einkemmer
[email protected] 2: A Python tool for computing RGEs at two-loop Craig Warren · Antonios Giannopoulos · Iraklis Giannakis · Iraklis Giannakis
A truly incompressible smoothed particle hydrodynamics based on artificial compressibility method Tonatiuh Rangel · Damien Caliste · Luigi Genovese · Marc Torrent · Marc Torrent
The accurate particle tracer code Kyle E. Niemeyer · Nicholas J. Curtis · Chih-Jen Sung · Chih-Jen Sung
eqtools: Modular, extensible, open-source, cross-machine Python tools for working with magnetic equilibria Fardin Rouzbahani · Kazem Hejranfar · Kazem Hejranfar
A robust and efficient numerical method to compute the dynamics of the rotating two-component dipolar Bose–Einstein condensates Yulei Wang · Jian Liu · Hong Qin · Hong Qin · Zhi Yu · Yicun Yao · Yicun Yao
Multiple elastic scattering of electrons in condensed matter Qinglin Tang · Qinglin Tang · Yong Zhang · Norbert Mauser · Norbert Mauser
Computational thermochemistry: Automated generation of scale factors for vibrational frequencies calculated by electronic structure model chemistries Aleksander Jablonski · Aleksander Jablonski
High performance computing for advanced modeling and simulation of materials Ioannis G. Tsoulos · Alexandros T. Tzallas · Dimitrios G. Tsalikakis · Dimitrios G. Tsalikakis
BioEM: GPU-accelerated computing of Bayesian inference of electron microscopy images Jue Wang · Fei Gao · José Luis Vázquez-Poletti · Jianjiang Li · Jianjiang Li
monteswitch : A package for evaluating solid–solid free energy differences via lattice-switch Monte Carlo ☆ Ashton S. Reimer · Alexei F. Cheviakov · Alexei F. Cheviakov
A unified Hamiltonian solution to Maxwell–Schrödinger equations for modeling electromagnetic field–particle interaction Pilar Cossio · David Rohr · Fabio Baruffa · Fabio Baruffa · Markus Rampp · V. Lindenstruth · Gerhard Hummer · Gerhard Hummer
Updated core libraries of the ALPS project T. L. Underwood · Graeme Ackland · Graeme Ackland
Monte Carlo Particle Lists: MCPL☆ Yongpin P. Chen · Wei E. I. Sha · Li Jun Jiang · Min Meng · Yu Mao Wu · Weng Cho Chew · Weng Cho Chew · Weng Cho Chew
Robust location of optical fiber modes via the argument principle method Thomas Kittelmann · Esben Bryndt Klinkby · Erik Knudsen · Peter Kjær Willendrup · Peter Kjær Willendrup · Xiao Xiao Cai · Xiao Xiao Cai · Kalliopi Kanaki · Kalliopi Kanaki
The Mobius domain wall fermion algorithm Parry Y. Chen · Parry Y. Chen · Yonatan Sivan · Yonatan Sivan
Applying polynomial filtering to mass preconditioned Hybrid Monte Carlo Richard C. Brower · Harmut Neff · Kostas Orginos · Kostas Orginos
Cross-platform validation and analysis environment for particle physics S. Chekanov · I. Pogrebnyak · I. Pogrebnyak · Daniel Wilbern · Daniel Wilbern
Hybrid-optimization strategy for the communication of large-scale Kinetic Monte Carlo simulation Jakub Chęciński · Marek Frankowski · Marek Frankowski
Parallel algorithms for islanded microgrid with photovoltaic and energy storage systems planning optimization problem: Material selection and quantity demand optimization M. Tuttafesta · G. Pascazio · Gianpiero Colonna · Gianpiero Colonna
SaaS enabled admission control for MCMC simulation in cloud computing infrastructures Hiroshi Tsukahara · Kaoru Iwano · Chiharu Mitsumata · T. Ishikawa · Kanta Ono · Kanta Ono
High-performance generation of the Hamiltonian and Overlap matrices in FLAPW methods R. Ramis · J. Meyer-ter-Vehn · J. Meyer-ter-Vehn
Phonon Unfolding: A program for unfolding phonon dispersions of materials Michael Wagner · Michael Wagner · Uwe Hampel · Uwe Hampel · Martina Bieberle · Martina Bieberle · Martina Bieberle
An efficient and portable SIMD algorithm for charge/current deposition in Particle-In-Cell codes ☆ Henri Vincenti · Henri Vincenti · Mathieu Lobet · R. Lehe · Ruchira Sasanka · Jean-Luc Vay · Jean-Luc Vay
TikZ-Feynman: Feynman diagrams with TikZ Toru Takahashi · Yuta Shimba · Hiroshi Isakari · Toshiro Matsumoto · Toshiro Matsumoto
Numerical path integral solution to strong Coulomb correlation in one dimensional Hookes atom Joshua P. Ellis · Joshua P. Ellis
APFELgrid: a high performance tool for parton density determinations Hongliang Lü · Anthony Marchix · Yasuhisa Abe · David Boilley · David Boilley
SusHi Bento: Beyond NNLO and the heavy-top limit Achim Guckenberger · Marcel P. Schraml · Paul G. Chen · Marc Leonetti · Stephan Gekle · Stephan Gekle
The Laguerre finite difference one-way equation solver G. F. Bertsch · J.M. Mehlhaff · J.M. Mehlhaff
INFFTM: Fast evaluation of 3d Fourier series in MATLAB with an application to quantum vortex reconnections Andrew V. Terekhov · Andrew V. Terekhov
RECOLA2: REcursive Computation of One-Loop Amplitudes 2 Marco Caliari · Simone Zuccher · Simone Zuccher
Controlling the numerical Cerenkov instability in PIC simulations using a customized finite difference Maxwell solver and a local FFT based current correction I.I. Gontchar · I.I. Gontchar · M.V. Chushnyakova · M.V. Chushnyakova · M.V. Chushnyakova
Collier: A fortran-based complex one-loop library in extended regularizations Thomas Jourdan · Gabriel Stoltz · Gabriel Stoltz · Frédéric Legoll · Frédéric Legoll · Laurent Monasse · Laurent Monasse
High-performance functional Renormalization Group calculations for interacting fermions Julian Lichtenstein · D. Sánchez de la Peña · D. Rohe · E. Di Napoli · E. Di Napoli · Carsten Honerkamp · S. A. Maier · S. A. Maier · S. A. Maier
A novel flexible field-aligned coordinate system for tokamak edge plasma simulation Jarrod Leddy · B. Dudson · M. Romanelli · Brendan William Shanahan · N. Walkden · N. Walkden
Real-time computation of parameter fitting and image reconstruction using graphical processing units Uldis Locans · Andreas Adelmann · Andreas Suter · Jannis Fischer · W. Lustermann · Günther Dissertori · Qiulin Wang · Qiulin Wang
Orthogonal fast spherical Bessel transform on uniform grid J. T. Childers · Thomas D. Uram · Thomas LeCompte · Michael E. Papka · Doug Benjamin · Doug Benjamin
Adapting the serial Alpgen parton-interaction generator to simulate LHC collisions on millions of parallel threads Sergei N. Yurchenko · Lorenzo Lodi · Jonathan Tennyson · Andrey V. Stolyarov · Andrey V. Stolyarov
Interfacial micro-currents in continuum-scale multi-component lattice Boltzmann equation hydrodynamics Andrey F. Pikelner · Andrey F. Pikelner
QSWalk: a Mathematica package for quantum stochastic walks on arbitrary graphs Federico Municchi · Christoph Goniva · Stefan Radl · Stefan Radl
GPU Based Detection of Topological Changes in Voronoi Diagrams José Luis Vázquez-Poletti · Rafael Moreno-Vozmediano · Rui Han · W. Wang · Ignacio Martín Llorente · Ignacio Martín Llorente
GPU Acceleration of the Locally Selfconsistent Multiple Scattering Code for First Principles Calculation of the Ground State and Statistical Physics of Materials Massimo Bernaschi · Matteo Lulli · Mauro Sbragaglia · Mauro Sbragaglia
The novel implicit LU-SGS parallel iterative method based on the diffusion equation of a nuclear reactor on a GPU cluster Markus Eisenbach · Jeff Larkin · Justin Lutjens · Steven C. Rennich · James H. Rogers · James H. Rogers
WavePacket: A Matlab package for numerical quantum dynamics. I: Closed quantum systems and discrete variable representations Jilin Zhang · Chaoqun Sha · Yusen Wu · Jian Wan · Li Zhou · Yongjian Ren · Huayou Si · Yuyu Yin · Ya Jing · Ya Jing
Linearized self-consistent quasiparticle GW method: Application to semiconductors and simple metals Burkhard Schmidt · Ulf Lorenz · Ulf Lorenz
Parallel 3-dim fast Fourier transforms with load balancing of the plane waves Fabien Bruneval · Fabien Bruneval · Tonatiuh Rangel · Tonatiuh Rangel · Samia M. Hamed · Meiyue Shao · Chao Yang · Jeffrey B. Neaton · Jeffrey B. Neaton · Jeffrey B. Neaton
Implementation of the Maximum Entropy Method for Analytic Continuation T. Loke · Jingbo B. Wang · Jingbo B. Wang
Implementation of the O(αt2) MSSM Higgs-mass corrections in FeynHiggs Thomas Hahn · Sebastian Paßehr · Sebastian Paßehr
LikeDM: Likelihood calculator of dark matter detection☆ I.K. Gainullin · I.K. Gainullin
The inclusion of two-loop SUSYQCD corrections to gluino and squark pole masses in the minimal and next-to-minimal supersymmetric standard model: SOFTSUSY3.7 Xiaoyuan Huang · Yue-Lin Sming Tsai · Qiang Yuan · Qiang Yuan · Qiang Yuan

Finite size effects in active microrheology in colloids
Computer Physics Communications | 2018
Christopher D. Cooper · Christopher D. Cooper · Lorena A. Barba · Lorena A. Barba