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Molecular Physics
An International Journal at the Interface Between Chemistry and Physics
Volume 103, 2005 - Issue 6-8: A Special Issue in Honour of Professor Nicholas C. Handy
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Original Articles

A variational method for the calculation of spin–rovibronic energy levels of any triatomic molecule in an electronic triplet state

Stuart Carter Department of Chemistry, University of Reading, RG6 2AD, UK
,
Nicholas C. Handy Department of Chemistry, University of Cambridge, CB2 1EW, UK
&
Riccardo Tarroni * Dipartimento di Chimica Fisica ed Inorganica, Università di Bologna, 40136 Bologna, Italy
Pages 1131-1137 | Received 04 Oct 2004, Accepted 07 Oct 2004, Published online: 21 Feb 2007

Citations (14)

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Riccardo Tarroni, Stuart Carter & Nicholas C. Handy. (2007) A theoretical spectroscopy study of the X 3Σ− and the A 3Π states of the C2S radical. Molecular Physics 105:9, pages 1129-1137.
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Articles from other publishers (13)

Leonid V. Poluyanov, Wolfgang Domcke & Sabyashachi Mishra. (2019) Spin-orbit vibronic coupling in Π4 states of linear triatomic molecules. The Journal of Chemical Physics 151:13.
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Emil J. Zak & Jonathan Tennyson. (2017) Ro-vibronic transition intensities for triatomic molecules from the exact kinetic energy operator; electronic spectrum for the C̃ 1B2 ← X̃ 1A1 transition in SO2. The Journal of Chemical Physics 147:9.
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Robert Grimminger, Dennis J. Clouthier, Riccardo Tarroni, Zhong Wang & Trevor J. Sears. (2013) An experimental and theoretical study of the electronic spectrum of HPS, a second row HNO analog. The Journal of Chemical Physics 139:17.
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Robert A. Grimminger & Dennis J. Clouthier. (2012) Toward an improved understanding of the AsH2 free radical: Laser spectroscopy, ab initio calculations, and normal coordinate analysis . The Journal of Chemical Physics 137:22.
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Alexander O. Mitrushchenkov. (2012) A new general Renner-Teller (including ɛ ≳ 1) spectroscopic formalism for triatomic molecules. The Journal of Chemical Physics 136:2.
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Riccardo Tarroni. (2011) Vibronic coupling in the A 2Π and B 2Σ+ electronic states of the NCS radical . The Journal of Chemical Physics 135:16.
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Stuart Carter, Amit R. Sharma, Joel M. Bowman, Pavel Rosmus & Riccardo Tarroni. (2009) Calculations of rovibrational energies and dipole transition intensities for polyatomic molecules using MULTIMODE . The Journal of Chemical Physics 131:22.
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Fumie X. Sunahori, Dennis J. Clouthier, Stuart Carter & Riccardo Tarroni. (2009) The electronic spectrum of the fluoroborane free radical. I. Theoretical calculation of the vibronic energy levels of the ground and first excited electronic states. The Journal of Chemical Physics 130:16.
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Etienne Garand, Tara I. Yacovitch & Daniel M. Neumark. (2008) Slow photoelectron imaging spectroscopy of CCO− and CCS−. The Journal of Chemical Physics 129:7.
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Jim Pfaendtner, Xinrui Yu & Linda J. Broadbelt. (2007) The 1-D hindered rotor approximation. Theoretical Chemistry Accounts 118:5-6, pages 881-898.
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Sabyashachi Mishra, Wolfgang Domcke & Leonid V. Poluyanov. (2007) A study of spin–orbit vibronic-coupling effects in the state of CCX (X = O, S, Se) and CNY (Y = N, P, As) . Chemical Physics Letters 446:4-6, pages 256-261.
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Sabyashachi Mishra, Leonid V. Poluyanov & Wolfgang Domcke. (2007) Spin-orbit vibronic coupling in Π3 states of linear triatomic molecules. The Journal of Chemical Physics 126:13.
Crossref
Riccardo Tarroni & Stuart Carter. (2005) Ab initio prediction of the infrared-absorption spectrum of the C2Cl radical . The Journal of Chemical Physics 123:1.
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