Open AccessVibrational and Homo-Lumo Analysis of L - Aspararginium Tartrate by Density Functional Theory
Author(s) -
E. Kavitha,
A. Shiny Febena,
R. Subaranjani,
J. Madhavan
Publication year - 2018
Publication title -
iop conference series. materials science and engineering
Language(s) - English
Resource type - Journals
eISSN - 1757-899X
pISSN - 1757-8981
DOI - 10.1088/1757-899x/360/1/012047
Subject(s) - homo/lumo , polarizability , dipole , tartrate , density functional theory , molecular orbital , chemistry , infrared , fourier transform infrared spectroscopy , polarizable continuum model , computational chemistry , molecular physics , solvent effects , solvent , molecule , physics , optics , organic chemistry