期刊
CHEMICAL PHYSICS LETTERS
卷 429, 期 1-3, 页码 310-316出版社
ELSEVIER SCIENCE BV
DOI: 10.1016/j.cplett.2006.07.086
关键词
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We propose a numerical scheme for the integration of the Langevin equation which is second-order accurate. More importantly, we indicate how to generalize this scheme to situations where holonomic constraints are added and show that the resulting scheme remains second-order accurate. (c) 2006 Elsevier B.V. All rights reserved.
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