Open AccessEffect of Exchange–correlation Functionals on Ground State Geometries, Optoelectronic and Charge Transfer of Triphenylamine-based Dyes
Author(s) -
Malak Lazrak,
Hamid Toufik,
Sliman Ennehary,
Si Mohamed Bouzzine,
Fatima Lamchouri
Publication year - 2022
Publication title -
orbital
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 0.167
H-Index - 4
ISSN - 1984-6428
DOI - 10.17807/orbital.v14i1.1682
Subject(s) - density functional theory , triphenylamine , hybrid functional , chemistry , charge (physics) , ground state , computational chemistry , atomic physics , physics , photochemistry , quantum mechanics