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Mühlhäuser, Max, Gruber-Stadler, Margret (2008) Ab initio MRD-CI study of excited states of formyl chloride HClCO and photofragmentation along Cl–C cleavage. Chemical Physics, 343. 311-318 doi:10.1016/j.chemphys.2007.10.026

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Reference TypeJournal (article/letter/editorial)
TitleAb initio MRD-CI study of excited states of formyl chloride HClCO and photofragmentation along Cl–C cleavage
JournalChemical Physics
AuthorsMühlhäuser, MaxAuthor
Gruber-Stadler, MargretAuthor
Year2008 (January)Volume343
PublisherElsevier BV
DOIdoi:10.1016/j.chemphys.2007.10.026Search in ResearchGate
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Mindat Ref. ID5961413Long-form Identifiermindat:1:5:5961413:3
GUID0
Full ReferenceMühlhäuser, Max, Gruber-Stadler, Margret (2008) Ab initio MRD-CI study of excited states of formyl chloride HClCO and photofragmentation along Cl–C cleavage. Chemical Physics, 343. 311-318 doi:10.1016/j.chemphys.2007.10.026
Plain TextMühlhäuser, Max, Gruber-Stadler, Margret (2008) Ab initio MRD-CI study of excited states of formyl chloride HClCO and photofragmentation along Cl–C cleavage. Chemical Physics, 343. 311-318 doi:10.1016/j.chemphys.2007.10.026
In(n.d.) Chemical Physics Vol. 343. Elsevier BV

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Schnell, Melanie, Mühlhäuser, Max, Peyerimhoff, Sigrid D. (2001) Ab initio MRD-CI study of excited states of chloromethanol ClCH2OH and photofragmentation along C–O and C–Cl cleavage. Chemical Physics Letters, 344. 519-526 doi:10.1016/s0009-2614(01)00817-x
Lesar, Antonija, Hodošček, Milan, Mühlhäuser, Max, Peyerimhoff, Sigrid D (2004) Ab initio MRD-CI study on the low-lying excited states of ClNO2. Chemical Physics Letters, 383. 84-88 doi:10.1016/j.cplett.2003.11.011
Gruber-Stadler, M., Mühlhäuser, M., Nielsen, C. J. (2006) Ab initio MRD-CI investigation of the electronic spectrum of glyoxal (CHO)2. Molecular Physics, 104. 2515-2521 doi:10.1080/00268970600797808
Schnell, Melanie, Mühlhäuser, Max, Froudakis, George E., Peyerimhoff, Sigrid D. (2001) Ab initio CCSD(T) and MRD-CI study of excited states and the electronic spectrum of linear C5+. Chemical Physics Letters, 340. 559-564 doi:10.1016/s0009-2614(01)00392-x
Lesar, Antonija, Kovačič, Saša, Hodošček, Milan, Mühlhäuser, Max, Peyerimhoff, Sigrid D. (2004) Ab Initio MRD-CI Study of the Electronic Spectrum of BrNO2and Photofragmentation. The Journal of Physical Chemistry A, 108 (43). 9469-9474 doi:10.1021/jp046599x
Gruber-Stadler, Margret, Mühlhäuser, Max, Sellevåg, Stig R., Nielsen, Claus J. (2008) A Quantum Chemistry Study of the Cl Atom Reaction with Formaldehyde. The Journal of Physical Chemistry A, 112 (1). 9-22 doi:10.1021/jp0753833
Mühlhäuser, M. (2003) Ab initioMRD-CI Study of the Electronic Spectrum of Tribromomethanol Br3COH and the Photofragmentation along Br–C and C–O Cleavage. Zeitschrift für Physikalische Chemie, 217 (3). 241-254 doi:10.1524/zpch.217.3.241.20467
Haubrich, Jan, Mühlhäuser, Max, Peyerimhoff, Sigrid D. (2003) Ab initio MRD-CI study of the electronic spectrum of linear C5H+. Journal of Molecular Structure: THEOCHEM, 623. 335-340 doi:10.1016/s0166-1280(02)00757-1
Lesar *, Antonija, Kovačič, Saša, Hodošček, Milan, Stadler, Margret G., MÜhlhÄuser, Max, Peyerimhoff, Sigrid D. (2005) Low-lying excited states and photodissociation studies ofcis-BrONO. Molecular Physics, 103. 2375-2380 doi:10.1080/00268970500105078
Fang, Wei-Hai, Liu, Ruo-Zhuang (2001) Ab initio studies of dissociation pathways on the ground- and excited-state potential energy surfaces for formyl chloride (HClCO). The Journal of Chemical Physics, 115 (22). 10431pp. doi:10.1063/1.1416174
Hachey, M., Grein, F., Steer, R.P. (1991) The 1A1 electronic excited states of H2CS: an ab initio MRD CI study. Chemical Physics Letters, 183. 204-208 doi:10.1016/0009-2614(91)80051-x
 
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