What Rules the Relative Stability of α-, β-, and γ-Glycine Polymorphs?
| Autor: | Neubi F. Xavier, Glauco F. Bauerfeldt, Antônio M. Da Silva |
|---|---|
| Rok vydání: | 2020 |
| Předmět: |
Materials science
010405 organic chemistry Thermodynamics General Chemistry 010402 general chemistry Condensed Matter Physics 01 natural sciences Relative stability 0104 chemical sciences Glycine Dispersion (optics) Physics::Atomic and Molecular Clusters Periodic boundary conditions General Materials Science Density functional theory |
| Zdroj: | Crystal Growth & Design. 20:4695-4706 |
| ISSN: | 1528-7505 1528-7483 |
| Popis: | Theoretical calculations based on the density functional theory, using the PBE functional with the D3 dispersion correction under periodic boundary conditions, have been employed aiming to investig... |
| Databáze: | OpenAIRE |
| Externí odkaz: |
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