Reliable modeling of the electronic spectra of realistic uranium complexes

P. Tecmer, N. Govind, K. Kowalski, W.A. de Jong, L. Visscher

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We present an EOMCCSD (equation of motion coupled cluster with singles and doubles) study of excited states of the small [UO

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title = "Reliable modeling of the electronic spectra of realistic uranium complexes",

abstract = "We present an EOMCCSD (equation of motion coupled cluster with singles and doubles) study of excited states of the small [UO",

author = "P. Tecmer and N. Govind and K. Kowalski and {de Jong}, W.A. and L. Visscher",

year = "2013",

doi = "10.1063/1.4812360",

language = "English",

volume = "139",

journal = "Journal of Chemical Physics",

issn = "0021-9606",

publisher = "American Institute of Physics Publising LLC",

number = "3",

}

TY - JOUR

T1 - Reliable modeling of the electronic spectra of realistic uranium complexes

AU - Tecmer, P.

AU - Govind, N.

AU - Kowalski, K.

AU - de Jong, W.A.

AU - Visscher, L.

PY - 2013

Y1 - 2013

N2 - We present an EOMCCSD (equation of motion coupled cluster with singles and doubles) study of excited states of the small [UO

AB - We present an EOMCCSD (equation of motion coupled cluster with singles and doubles) study of excited states of the small [UO

U2 - 10.1063/1.4812360

DO - 10.1063/1.4812360

M3 - Article

VL - 139

JO - Journal of Chemical Physics

JF - Journal of Chemical Physics

SN - 0021-9606

IS - 3

M1 - 034301

ER -