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Properties of Fluids Modelled by Force Fields with Intramolecular Contributions: Application to Heat Capacities.
- 1.0480402 - ÚCHP 2018 RIV US eng J - Journal Article
Smith, W.R. - Jirsák, Jan - Nezbeda, Ivo - Qi, W.
Properties of Fluids Modelled by Force Fields with Intramolecular Contributions: Application to Heat Capacities.
Journal of Chemical Physics. Roč. 147, č. 3 (2017), č. článku 034508. ISSN 0021-9606. E-ISSN 1089-7690
R&D Projects: GA ČR GA15-19542S
Grant - others:NSERC(CA) STPGP479466-15
Institutional support: RVO:67985858
Keywords : thermodynamic derivative properties * linear contraint solver * monte-carlo simulation
OECD category: Physical chemistry
Impact factor: 2.843, year: 2017
Permanent Link: http://hdl.handle.net/11104/0276184File Download Size Commentary Version Access The Journal of Chemical Physics Volume 147 issue 3 2017 [doi 10.1063_1.4993572] Smith, William R.; Jirsák, Jan; Nezbeda, Ivo; Qi, Weikai -- Molecular simulation of ca.pdf 0 700.7 KB Publisher’s postprint open-access
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