Open AccessStructural Parameters, Electronic, Spectroscopic and Nonlinear Optical Theoretical Research of 1-(m-Chlorophenyl)piperazine (mCPP) Molecule
Author(s) -
Yavuz Ekíncíoğlu,
Hamdi Şükür Kılıç,
Ömer Derelı
Publication year - 2020
Publication title -
turkish computational and theoretical chemistry/turkish computational and theoretical chemistry :
Language(s) - English
Resource type - Journals
eISSN - 2587-1722
pISSN - 2602-3237
DOI - 10.33435/tcandtc.811494
Subject(s) - molecule , homo/lumo , ionization energy , density functional theory , computational chemistry , electron affinity (data page) , molecular orbital , basis set , chemistry , natural bond orbital , electronic structure , raman spectroscopy , molecular geometry , ionization , chemical physics , physics , organic chemistry , ion , optics