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Vibrational, electronic, spectroscopic properties, and NBO analysis of p-xylene, 3,6-difluoro-p-xylene, 3,6-dichloro-p-xylene and 3,6-dibromo-pxylene: DFT study.
Heliyon. 2020 Dec 23;6(12):e05783. doi: 10.1016/j.heliyon.2020.e05783. eCollection 2020 Dec.
Heliyon. 2020.
PMID: 33385089
Free PMC article.
Evaluation of the bound state energies of some diatomic molecules from the approximate solutions of the Schrodinger equation with Eckart plus inversely quadratic Yukawa potential.
Ita BI, Louis H, Ubana EI, Ekuri PE, Leonard CU, Nzeata NI.
Ita BI, et al. Among authors: ubana ei.
J Mol Model. 2020 Nov 24;26(12):349. doi: 10.1007/s00894-020-04593-0.
J Mol Model. 2020.
PMID: 33236232
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