Molecular Modeling of Solid Fluid Phase Behavior | Zendy

P. A. Monson | Zendy

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Molecular Modeling of Solid Fluid Phase Behavior

Author(s) -

P. A. Monson

Publication year - 2007

Publication title -

osti oai (u.s. department of energy office of scientific and technical information)

Language(s) - English

Resource type - Reports

DOI - 10.2172/937081

Subject(s) - solid surface , work (physics) , phase (matter) , engineering ethics , engineering , mechanical engineering , chemistry , chemical physics , organic chemistry

This report gives a summary of the achievements under DOE contract No. DOE/ER/14150 during the period September 1, 1990 to December 31, 2007. This project was concerned with the molecular modeling of solid-fluid equilibrium. The focus was on understanding how solid-fluid and solid-solid phase behavior are related to molecular structure, and the research program made a seminal contribution in this area. The project led to 34 journal articles, including a comprehensive review article published in Advances in Chemical Physics. The DOE funding supported the work of 5 Ph.D. students, 2 M.S. students and 5 postdoctoral researchers

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