Molecular dynamics simulation, DFT calculations and vibrational spectroscopic study of N H•••O bound dimer models for DL-β-phenylalanine and 3-amino-3-(4-chlorophenyl)propionic acid

Autor:	L. Pallavi, J. Tonannavar, Jayashree Tonannavar
Rok vydání:	2022
Předmět:	Materials Chemistry Physical and Theoretical Chemistry Condensed Matter Physics Spectroscopy Atomic and Molecular Physics and Optics Electronic Optical and Magnetic Materials
Zdroj:	Journal of Molecular Liquids. 352:118746
ISSN:	0167-7322
DOI:	10.1016/j.molliq.2022.118746
Databáze:	OpenAIRE
Externí odkaz:	https://explore.openaire.eu/search/publication?articleId=doi_________::2ae71a25c65aba51d3657fe5cb155849 https://doi.org/10.1016/j.molliq.2022.118746 Zobrazit plný text záznamu Full Text from ScienceDirect