Systematic study on the TD-DFT calculated electronic circular dichroism spectra of chiral aromatic nitro compounds: A comparison of B3LYP and CAM-B3LYP

dc.contributor.author	Komjáti Balázs
dc.contributor.author	Urai Ákos
dc.contributor.author	Hosztafi Sándor
dc.contributor.author	Kökösi József
dc.contributor.author	Kováts Benjámin
dc.contributor.author	Nagy József
dc.contributor.author	Horváth Péter
dc.date.accessioned	2018-02-27T19:35:01Z
dc.date.available	2018-02-27T19:35:01Z
dc.date.issued	2016
dc.identifier	84946887286
dc.identifier.citation	pagination=95-102; journalVolume=155; journalTitle=SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY;
dc.identifier.uri	http://repo.lib.semmelweis.hu//handle/123456789/5040
dc.identifier.uri	doi:10.1016/j.saa.2015.11.002
dc.relation.ispartof	urn:issn:1386-1425
dc.title	Systematic study on the TD-DFT calculated electronic circular dichroism spectra of chiral aromatic nitro compounds: A comparison of B3LYP and CAM-B3LYP
dc.type	Journal Article
dc.date.updated	2018-02-27T19:34:17Z
dc.language.rfc3066	en
dc.identifier.mtmt	2967208
dc.identifier.wos	000367020700012
dc.identifier.pubmed	26583523
dc.contributor.department	SE/GYTK/Gyógyszerészi Kémiai Intézet
dc.contributor.institution	Semmelweis Egyetem