Predicting miscibility of binary liquids from small cluster QCE calculations.

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Predicting miscibility of binary liquids from small cluster QCE calculations.

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2017 nî lūn-bûn

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Predicting miscibility of binary liquids from small cluster QCE calculations.

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Predicting miscibility of binary liquids from small cluster QCE calculations.

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Predicting miscibility of binary liquids from small cluster QCE calculations.

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P1476

Predicting miscibility of binary liquids from small cluster QCE calculations

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P2093

Johannes Ingenmey

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P2860

van der Waals Volumes and Radii

Development and testing of a general amber force field

Consistent structures and interactions by density functional theory with small atomic orbital basis sets.

Structural properties of methanol-water binary mixtures within the quantum cluster equilibrium model.

A density functional theory study of the benzene-water complex.

A theoretical study of water equilibria: the cluster distribution versus temperature and pressure for (H2O)n, n = 1-60, and ice.

Modeling nonionic aqueous solutions: the acetone-water mixture.

The water-benzene interaction: insight from electronic structure theories.

Water-benzene interactions: an effective fragment potential and correlated quantum chemistry study.

Quantum cluster equilibrium model of N-methylformamide-water binary mixtures.

P304

154502

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P31

scholarly article

P356

10.1063/1.4980032

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P407

English

P433

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P478

146

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P50

Barbara Kirchner

Michael von Domaros

P577

2017-04-01T00:00:00Z

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P698

28433040

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