Molecular dynamics simulations of the relaxation processes in the condensed matter on GPUs

التفاصيل البيبلوغرافية
العنوان: Molecular dynamics simulations of the relaxation processes in the condensed matter on GPUs
المؤلفون: V. V. Pisarev, R. G. Bystryi, Vladimir V. Stegailov, Genri E. Norman, Andrey Kazennov, Igor V. Morozov
المصدر: Computer Physics Communications. 182:1974-1978
بيانات النشر: Elsevier BV, 2011.
سنة النشر: 2011
مصطلحات موضوعية: Computer science, General Physics and Astronomy, Crystallization rate, Computational science, Condensed Matter::Soft Condensed Matter, Computer Science::Performance, Molecular dynamics, Computer Science::Graphics, Atom (system on chip), Hardware and Architecture, Metastability, Computer Science::Mathematical Software, Relaxation (approximation), General-purpose computing on graphics processing units, Graphics, ComputingMethodologies_COMPUTERGRAPHICS
الوصف: We report on simulation technique and benchmarks for molecular dynamics simulations of the relaxation processes in solids and liquids using the graphics processing units (GPUs). The implementation of a many-body potential such as the embedded atom method (EAM) on GPU is discussed. The benchmarks obtained by LAMMPS and HOOMD packages for simple Lennard-Jones liquids and metals using EAM potentials are presented for both Intel CPUs and Nvidia GPUs. As an example the crystallization rate of the supercooled Al melt is computed.
تدمد: 0010-4655
الوصول الحر: https://explore.openaire.eu/search/publication?articleId=doi_________::3d29cd767e8fa9b14af6d5681e2b711cTest
https://doi.org/10.1016/j.cpc.2010.12.026Test
حقوق: CLOSED
رقم الانضمام: edsair.doi...........3d29cd767e8fa9b14af6d5681e2b711c
قاعدة البيانات: OpenAIRE