A Quantitative Prediction of the Electronic Spectra of Thiocarbonyl Chromophores: TD-DFT versus SAC-CI

Julien Preat, Denis Jacquemin, Daniel Vercauteren, Eric Perpète

Research output: Contribution to journal › Article › peer-review

Original language	English
Pages (from-to)	463-468
Number of pages	6
Journal	Theoretical Chemistry Accounts
Volume	119
Publication status	Published - 2008

Cite this

@article{d149d463fe37484783a46b90813f14bd,

title = "A Quantitative Prediction of the Electronic Spectra of Thiocarbonyl Chromophores: TD-DFT versus SAC-CI",

author = "Julien Preat and Denis Jacquemin and Daniel Vercauteren and Eric Perp{\`e}te",

note = "Publication code : RES. ACAD.",

year = "2008",

language = "English",

volume = "119",

pages = "463--468",

journal = "Theoretical Chemistry Accounts",

issn = "1432-881X",

publisher = "Springer New York",

}

TY - JOUR

T1 - A Quantitative Prediction of the Electronic Spectra of Thiocarbonyl Chromophores: TD-DFT versus SAC-CI

AU - Preat, Julien

AU - Jacquemin, Denis

AU - Vercauteren, Daniel

AU - Perpète, Eric

N1 - Publication code : RES. ACAD.

PY - 2008

Y1 - 2008

M3 - Article

SN - 1432-881X

VL - 119

SP - 463

EP - 468

JO - Theoretical Chemistry Accounts

JF - Theoretical Chemistry Accounts

ER -