%0 Journal Article
%T A Density Functional Theory (DFT) Investigation on the Structure and Spectroscopic Behavior of 2-Aminoterephthalic Acid and Its Sodium Salts
%A Mohammad A. Matin
%A Samiran Bhattacharjee
%A Md. Aftab Ali Shaikh
%A Tapas Debnath
%A Mohammed Abdul Aziz
%J Green and Sustainable Chemistry
%P 39-55
%@ 2160-696X
%D 2020
%I Scientific Research Publishing
%R 10.4236/gsc.2020.102004
%X As a substitute for lithium ion batteries, Na
chemistry for ion battery systems is promising materials for energy storage
applications for the next generation.
Herein, the
structures, IR and UV-visible spectra of 2-aminoterephthalic acid (H2ATA), disodium 2-aminoterephthalate (Na2ATA),
trisodium 2-aminotere-phthalate (Na3ATA) and tetrasodium
2-aminoterephthalate (Na4ATA) have been studied using
density functional theory (DFT/B3LYP/6-311++G(d,p)).
The
%K 2-Aminoterephthalic Acid
%K Sodium 2-Aminoterephthalate
%K Trisodium 2-Aminoterephthalate
%K Tetrasodium 2-Aminoterephthalate
%K Density Functional Theory
%U http://www.scirp.org/journal/PaperInformation.aspx?PaperID=98790