Chemical potential calculations in non-homogeneous liquids-Reference-Cited by-同舟云学术

Chemical potential calculations in non-homogeneous liquids

Published:2018-08-21 Issue:7 Volume:149 Page:072305
ISSN:0021-9606
Container-title:The Journal of Chemical Physics
language:en
Short-container-title:The Journal of Chemical Physics

Author:

Perego Claudio¹²³^ORCID,Valsson Omar¹²³^ORCID,Parrinello Michele²³

Affiliation:

1. Department of Polymer Theory, Max-Planck Institute for Polymer Research, Ackermannweg 10, D-55128 Mainz, Germany

2. Department of Chemistry and Applied Biosciences, ETH Zurich, c/o USI Campus, Via Giuseppe Buffi 13, CH-6900 Lugano, Switzerland

3. Institute of Computational Science, National Center for Computational Design and Discovery of Novel Materials MARVEL, Università della Svizzera italiana, Via Giuseppe Buffi 13, CH-6900 Lugano, Switzerland

Funder

H2020 European Research Council

National Center of Competence in Research Materials' Revolution: Computational Design and Discovery of Novel Materials

Publisher

AIP Publishing

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://aip.scitation.org/doi/pdf/10.1063/1.5024631

Reference39 articles.

1. Chemical potential—a quantity in search of recognition

2. The elusive chemical potential

3. Some Topics in the Theory of Fluids

4. Efficient estimation of free energy differences from Monte Carlo data

5. Accuracy of free-energy perturbation calculations in molecular simulation. I. Modeling

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