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Ehara, Masahiro, Piecuch, Piotr, Lutz, Jesse J., Gour, Jeffrey R. (2012) Symmetry-adapted-cluster configuration-interaction and equation-of-motion coupled-cluster studies of electronically excited states of copper tetrachloride and copper tetrabromide dianions. Chemical Physics, 399. 94-110 doi:10.1016/j.chemphys.2011.09.022

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Reference TypeJournal (article/letter/editorial)
TitleSymmetry-adapted-cluster configuration-interaction and equation-of-motion coupled-cluster studies of electronically excited states of copper tetrachloride and copper tetrabromide dianions
JournalChemical Physics
AuthorsEhara, MasahiroAuthor
Piecuch, PiotrAuthor
Lutz, Jesse J.Author
Gour, Jeffrey R.Author
Year2012 (May)Volume399
PublisherElsevier BV
DOIdoi:10.1016/j.chemphys.2011.09.022Search in ResearchGate
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Mindat Ref. ID5962967Long-form Identifiermindat:1:5:5962967:6
GUID0
Full ReferenceEhara, Masahiro, Piecuch, Piotr, Lutz, Jesse J., Gour, Jeffrey R. (2012) Symmetry-adapted-cluster configuration-interaction and equation-of-motion coupled-cluster studies of electronically excited states of copper tetrachloride and copper tetrabromide dianions. Chemical Physics, 399. 94-110 doi:10.1016/j.chemphys.2011.09.022
Plain TextEhara, Masahiro, Piecuch, Piotr, Lutz, Jesse J., Gour, Jeffrey R. (2012) Symmetry-adapted-cluster configuration-interaction and equation-of-motion coupled-cluster studies of electronically excited states of copper tetrachloride and copper tetrabromide dianions. Chemical Physics, 399. 94-110 doi:10.1016/j.chemphys.2011.09.022
In(n.d.) Chemical Physics Vol. 399. Elsevier BV

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Ohtsuka, Yuhki, Piecuch, Piotr, Gour, Jeffrey R., Ehara, Masahiro, Nakatsuji, Hiroshi (2007) Active-space symmetry-adapted-cluster configuration-interaction and equation-of-motion coupled-cluster methods for high accuracy calculations of potential energy surfaces of radicals. The Journal of Chemical Physics, 126 (16). 164111pp. doi:10.1063/1.2723121
Gour, Jeffrey R., Piecuch, Piotr, Włoch, Marta (2005) Active-space equation-of-motion coupled-cluster methods for excited states of radicals and other open-shell systems: EA-EOMCCSDt and IP-EOMCCSDt. The Journal of Chemical Physics, 123 (13). 134113pp. doi:10.1063/1.2042452
Nakatsuji, Hiroshi, Ehara, Masahiro (1994) Symmetry adapted cluster‐configuration interaction study on the excited and ionized states of TiBr4 and TiI4. The Journal of Chemical Physics, 101 (9). 7658-7671 doi:10.1063/1.468259
Hansen, Jared A, Piecuch, Piotr, Lutz, Jesse J, Gour, Jeffrey R (2011) Geometries and adiabatic excitation energies of the low-lying valence states of CNC, C2N, N3and NCO studied with the electron-attached and ionized equation-of-motion coupled-cluster methodologies. Physica Scripta, 84 (2). 28110pp. doi:10.1088/0031-8949/84/02/028110
Honda, Yasushi, Hada, Masahiko, Ehara, Masahiro, Nakatsuji, Hiroshi (2002) Excited and ionized states of aniline: Symmetry adapted cluster configuration interaction theoretical study. The Journal of Chemical Physics, 117 (5). 2045-2052 doi:10.1063/1.1487827
Lutz, Jesse J., Piecuch, Piotr (2014) Performance of the completely renormalized equation-of-motion coupled-cluster method in calculations of excited-state potential cuts of water. Computational and Theoretical Chemistry, 1040. 20-34 doi:10.1016/j.comptc.2014.05.008
Gour, Jeffrey R., Piecuch, Piotr (2006) Efficient formulation and computer implementation of the active-space electron-attached and ionized equation-of-motion coupled-cluster methods. The Journal of Chemical Physics, 125 (23). 234107pp. doi:10.1063/1.2409289
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Li, Xiangzhu, Gour, Jeffrey R., Paldus, Josef, Piecuch, Piotr (2008) On the significance of quadruply excited clusters in coupled-cluster calculations for the low-lying states of BN and C2. Chemical Physics Letters, 461. 321-326 doi:10.1016/j.cplett.2008.07.004
 
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