Calculation of Five Thermodynamic Molecular Descriptors by Means of a General Computer Algorithm Based on the Group-Additivity Method: Standard Enthalpies of Vaporization, Sublimation and Solvation, and Entropy of Fusion of Ordinary Organic Molecules and Total Phase-Change Entropy of Liquid Crystals

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This article presents the calculation of the standard enthalpies of vaporization, sublimation and solvation of organic molecules using a common computer algorithm on the basis of a group-additivity method.

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41 p.

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Naef, Rudolf & Acree, William E. (William Eugene) June 25, 2017.

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This article presents the calculation of the standard enthalpies of vaporization, sublimation and solvation of organic molecules using a common computer algorithm on the basis of a group-additivity method.

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41 p.

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  • Molecules, 22(7), MDPI, June 25, 2017, pp. 1-

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  • Publication Title: Molecules
  • Volume: 22
  • Issue: 7
  • Peer Reviewed: Yes

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  • June 25, 2017

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  • July 11, 2017, 7:49 p.m.

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  • Dec. 12, 2023, 2:55 p.m.

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Naef, Rudolf & Acree, William E. (William Eugene). Calculation of Five Thermodynamic Molecular Descriptors by Means of a General Computer Algorithm Based on the Group-Additivity Method: Standard Enthalpies of Vaporization, Sublimation and Solvation, and Entropy of Fusion of Ordinary Organic Molecules and Total Phase-Change Entropy of Liquid Crystals, article, June 25, 2017; Basel, Switzerland. (https://digital.library.unt.edu/ark:/67531/metadc984102/: accessed March 19, 2024), University of North Texas Libraries, UNT Digital Library, https://digital.library.unt.edu; crediting UNT College of Science.

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