期刊
MOLECULAR SIMULATION
卷 37, 期 6, 页码 457-465出版社
TAYLOR & FRANCIS LTD
DOI: 10.1080/08927022.2011.552244
关键词
canonical ensemble; isobaric heat capacity; speed of sound; Joule-Thomson coefficient
Explicit statistical analogues are given for the isobaric heat capacity, the speed of sound and the Joule-Thomson coefficient in the canonical ensemble. The results can directly serve as rigorous measuring prescriptions in existing molecular NVT simulation codes.
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