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Article information
2001 , Volume 6, ¹ 3, p.32-50
Mirniy V., Frohner M.
On one computer program for modelling of molecular dynamics of gas with elements of algorithm parallelization
This article is devoted to the modelling of Newtonian molecular dynamics of gas. Modern numerical methods for solution of the problem are considered. On the basis of these methods the software package on C++ with usage of parallel computations is developed.
[full text] Classificator Msc2000:- *65Y05 Parallel computation
- 76M28 Particle methods and lattice-gas methods
- 76N15 Gas dynamics, general
- 82B21 Continuum models (systems of particles, etc.)
Classificator Computer Science:- *G.4 Mathematical Software
- G.1.0 General (Numerical Analysis)
- J.2 Physical Sciences and Engineering (Computer Applications)
Keywords: molecular dynamic, numeric methods, parallel algorithms, molecular dynamics simulation, symplectic integration, Newtonian gas, algorithm parallelization
Author(s):
Mirniy V
Address: Germany, Kotbus
E-mail: myrnyvo@tu-cottbus.de
Frohner M
Address: Germany, Kotbus
E-mail: myrnyvo@tu-cottbus.de
Bibliography link:
Mirniy V., Frohner M. On one computer program for modelling of molecular dynamics of gas with elements of algorithm parallelization // Computational technologies. 2001. V. 6. ¹ 3. P. 32-50
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