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Bulk properties and structural features of deuterated methanols in heavy and light water

✍ Scribed by V. K. Abrosimov; A. N. Strakhov; E. V. Ivanov

Publisher
SP MAIK Nauka/Interperiodica
Year
1990
Tongue
English
Weight
323 KB
Volume
31
Category
Article
ISSN
0022-4766

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Thermodynamic and structural properties of methanol–water solutions using nonadditive interaction models
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## Abstract We study bulk structural and thermodynamic properties of methanol–water solutions via molecular dynamics simulations using novel interaction potentials based on the charge equilibration (fluctuating charge) formalism to explicitly account for molecular polarization at the atomic level.