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JournalISSN: 0010-4655

Computer Physics Communications 

Elsevier BV
About: Computer Physics Communications is an academic journal published by Elsevier BV. The journal publishes majorly in the area(s): Monte Carlo method & Computer science. It has an ISSN identifier of 0010-4655. Over the lifetime, 10111 publications have been published receiving 433107 citations.


Papers
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Journal ArticleDOI
TL;DR: A parallel message-passing implementation of a molecular dynamics program that is useful for bio(macro)molecules in aqueous environment is described and can handle rectangular periodic boundary conditions with temperature and pressure scaling.

8,195 citations

Journal ArticleDOI
TL;DR: PYTHIA 8 represents a complete rewrite in C++, and does not yet in every respect replace the old code, but does contain some new physics aspects that should make it an attractive option especially for LHC physics studies.

5,325 citations

Journal ArticleDOI
TL;DR: An overview of NWChem is provided focusing primarily on the core theoretical modules provided by the code and their parallel performance, as well as Scalable parallel implementations and modular software design enable efficient utilization of current computational architectures.

4,666 citations

Journal ArticleDOI
TL;DR: Pythia 8.2 is the second main release after the complete rewrite from Fortran to C++, and now has reached such a maturity that it offers a complete replacement for most applications, notably for LHC physics studies.

4,503 citations

Journal ArticleDOI
TL;DR: It is shown how derivatives of the GPW energy functional, namely ionic forces and the Kohn–Sham matrix, can be computed in a consistent way and the computational cost is scaling linearly with the system size, even for condensed phase systems of just a few tens of atoms.

4,047 citations

Performance
Metrics
No. of papers from the Journal in previous years
YearPapers
2023169
2022484
2021337
2020254
2019288
2018200