MASSIVELY-PARALLEL MONTE-CARLO SIMULATIONS ON CM2 FOR GAS-ADSORPTION IN ZEOLITE MOLECULAR-SIEVES

Authors
CHEN A HIRTZEL CS
Citation
A. Chen et Cs. Hirtzel, MASSIVELY-PARALLEL MONTE-CARLO SIMULATIONS ON CM2 FOR GAS-ADSORPTION IN ZEOLITE MOLECULAR-SIEVES, The international journal of supercomputer applications and high performance computing, 8(1), 1994, pp. 54-63
Citations number
13
Categorie Soggetti
Computer Application, Chemistry & Engineering","Computer Sciences, Special Topics","Computer Science Hardware & Architecture","Computer Science Interdisciplinary Applications
Journal title
The international journal of supercomputer applications and high performance computing → ACNP
ISSN journal
10783482
Volume
8
Issue
1
Year of publication
1994
Pages
54 - 63
Database
ISI
SICI code
1078-3482(1994)8:1<54:MMSOCF>2.0.ZU;2-K
Abstract
A massively parallel scheme for gas adsorption in zeolite molecular si eves based on the Macro State Markov Chain Model (Chen, 1993; Chen and Hirtzel, 1993a) has been developed and implemented on the Connection Machine CM2. Implementation details that are important in achieving hi gh efficiency of the parallel algorithm are described. The results sho w that the parallel implementation is very efficient, and that simulat ion time is dramatically reduced in comparison with conventional seque ntial schemes.