Quantum Chemical Calculations by Parallel Computer from Commodity PC

Computational quantum chemistry helps us to determine, calculate, and study new concepts, compounds, reactions and mechanisms. Such way is very useful with compounds that require exceptionally care in their handling, such as explosives, decreasing risk to persons testing and maintenance costs in se...

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Bibliographic Details
Main Authors: S. Bekešienė, S. Sėrikovienė
Format: Article
Language:English
Published: Vilnius University Press 2007-10-01
Series:Nonlinear Analysis
Subjects:
Online Access:http://www.zurnalai.vu.lt/nonlinear-analysis/article/view/14677