Theory of melting of molecular crystals within the new modified model: The complete pictures of the transition temperatures |
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| Affiliation: | 1. Department of Physics, Erciyes University, 38039 Kayseri, Turkey;2. Department of Physics, Kahramanmaraş Sütçü İmam University, 46100 Kahramanmaraş, Turkey;1. Department of Physical Chemistry of Supramolecular Complexes, Institute of Physical Chemistry, Polish Academy of Sciences (IPC PAS), Kasprzaka 44/52, 01-224 Warsaw, Poland;2. Department of Chemistry, University of North Texas, 1155 Union Circle, #305070, Denton, TX 76203-5017, USA;3. Faculty of Mathematics and Natural Sciences, School of Science, Cardinal Stefan Wyszynski University in Warsaw, Wóycickiego 1/3, 01-815 Warsaw, Poland;1. Hubei Key Laboratory for Processing and Application of Catalytic Materials, College of Chemistry and Chemical Engineering, Huanggang Normal University, Huanggang, 438000, China;2. Laiwu No.1 Middle School, Jinan City, Shandong Province, 271100, China;3. Analysis and Testing Center, Lanzhou University, Lanzhou, 730000, China;1. Université Paris-Saclay, CNRS, Institut des Sciences Moléculaires D’Orsay, 91405, Orsay, France;2. Laboratoire de Chimie Théorique, Sorbonne Université, UMR 7616 CNRS, 4, Place Jussieu, 75005, Paris, France;1. Department of Pharmacy, Faculty of Health and Medical Sciences, University of Copenhagen, Universitetsparken 2, 2100 Copenhagen, Denmark;2. Drug Delivery, Disposition and Dynamics, Monash Institute of Pharmaceutical Sciences, Monash University (Parkville Campus), 381 Royal Parade, Parkville, VIC, Australia;3. ARC Centre of Excellence in Convergent Bio-Nano Science and Technology, Monash Institute of Pharmaceutical Sciences, Monash University (Parkville Campus), 381 Royal Parade, Parkville, VIC, Australia;4. SAXS/WAXS Beamline, Australian Synchrotron, Clayton, VIC, Australia;5. MAX IV Laboratory/Lund University, Ole Römers väg 1, 223 63 Lund, Sweden;1. Pharmaceutical Science and Technologies, Eisai Co., Ltd., 1 Kawashimatakehaya-machi, Kakamigahara, Gifu 501-6195, Japan;2. Department of Pharmaceutical Engineering, School of Pharmacy, Aichi Gakuin University, 1-100 Kusumoto, Chikusaku, Nagoya, Aichi 464-8650, Japan |
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| Abstract: | The new modified form of the Pople–Karasz theory of melting of molecular crystals was introduced and applied to investigate the thermodynamics of melting, solid–solid, solid–nematic and nematic–isotropic liquid transitions in the previous papers. In this paper, we give the complete pictures of the transition temperatures and compare with the original Pople–Karasz (PK) theory and its previous modified theories. We also found that the new modified model also gives a much better agreement with available experimental data for the solid–nematic transition than the PK and its previous modified theories by using the different adjustable parameters. |
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