formation thermodynamics
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Solvent and structural effects on silver(I) complex formation: thermodynamics and modeling

2021 ◽  
Author(s):  
P. L. Zanonato ◽  
P. Di Bernardo ◽  
A. Melchior ◽  
M. Tolazzi ◽  
P. Polese ◽  
...  
Keyword(s):  
Complex Formation ◽  
Structural Effects ◽  
Formation Thermodynamics

Novel cocrystals of itraconazole: Insights from phase diagrams, formation thermodynamics and solubility

2021 ◽  
Vol 599 ◽  
pp. 120441
Author(s):  
Nikita A. Vasilev ◽  
Artem O. Surov ◽  
Alexander P. Voronin ◽  
Ksenia V. Drozd ◽  
German L. Perlovich
Keyword(s):  
Phase Diagrams ◽  
Formation Thermodynamics

Complex structures, formation thermodynamics and substitution reaction kinetics in the copper(II) – glycylglycylglycine – l/d/dl-histidine system

Polyhedron ◽  
2021 ◽  
Vol 197 ◽  
pp. 115041
Author(s):  
Nikita Yu. Serov ◽  
Valery G. Shtyrlin ◽  
Mikhail S. Bukharov ◽  
Anton V. Ermolaev ◽  
Edward M. Gilyazetdinov ◽  
...  
Keyword(s):  
Reaction Kinetics ◽  
Substitution Reaction ◽  
Complex Structures ◽  
Formation Thermodynamics

A combined experimental and theoretical study of miconazole salts and cocrystals: crystal structures, DFT computations, formation thermodynamics and solubility improvement

2021 ◽  
Author(s):  
Ksenia V. Drozd ◽  
Alex N. Manin ◽  
Alexander P. Voronin ◽  
Denis Boycov ◽  
Churakov Andrei ◽  
...  
Keyword(s):  
Crystal Structures ◽  
Theoretical Study ◽  
Molecular Crystals ◽  
Dicarboxylic Acids ◽  
Antifungal Drug ◽  
Crystal Forms ◽  
Dft Computations ◽  
Solubility Improvement ◽  
Aliphatic Dicarboxylic Acids ◽  
Formation Thermodynamics

Experimental and theoretical screening of multi-component crystal forms of miconazole (MCL), an antifungal drug, with ten aliphatic dicarboxylic acids was performed. Seven multi-component molecular crystals were isolated and identified by...

Formation Thermodynamics, Stability, and Decomposition Pathways of CsPbX3 (X = Cl, Br, I) Photovoltaic Materials

2020 ◽  
Vol 124 (7) ◽  
pp. 4252-4260 ◽  
Author(s):  
Dmitry S. Tsvetkov ◽  
Maxim O. Mazurin ◽  
Vladimir V. Sereda ◽  
Ivan L. Ivanov ◽  
Dmitry A. Malyshkin ◽  
...  
Keyword(s):  
Photovoltaic Materials ◽  
Formation Thermodynamics

scholarly journals On glass formation thermodynamics: Enthalpy vs. Entropy

2020 ◽  
Vol 69 (19) ◽  
pp. 196401
Author(s):  
Li-Min Wang ◽  
Ri-Ping Liu ◽  
Yong-Jun Tian
Keyword(s):  
Glass Formation ◽  
Formation Thermodynamics

scholarly journals Solution and calorimetric thermodynamic study of a new 1 : 1 sulfamethazine–3-methylsalicylic acid co-crystal

CrystEngComm ◽  
2020 ◽  
Vol 22 (20) ◽  
pp. 3463-3473 ◽  
Author(s):  
Dipali Ahuja ◽  
Michael Svärd ◽  
Matteo Lusi ◽  
Åke C. Rasmuson
Keyword(s):  
Enthalpy Change ◽  
Thermodynamic Study ◽  
Formation Thermodynamics

The formation thermodynamics of a new 1 : 1 sulfamethazine–3-methylsalicylic acid co-crystal reveals spontaneity of formation associated with a positive enthalpy change.

Understanding the formation thermodynamics of fresnoitic trivanadates: DFT calculations and soft base hydrolysis synthesis

2019 ◽  
Vol 124 ◽  
pp. 7-12
Author(s):  
G.S. Zakharova ◽  
A.N. Enyashin ◽  
N.V. Podval'naya ◽  
R.S. Gorodetsky ◽  
N.I. Kadyrova ◽  
...  
Keyword(s):  
Dft Calculations ◽  
Base Hydrolysis ◽  
Formation Thermodynamics
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