References
- Tyndal , GS and Ravishankara , AR . 1991 . Int. J. Chem. Kinetics , 23 : 483
- Wang , NS and Howard , CJ . 1990 . J. Phys. Chem. , 94 : 8787
- Lovejoy , ER and Wang , NS . 1987 . J. Phys. Chem. , 91 : 5749
- Lee , Y-Y , Lee , Y-P and Wang , NS . 1994 . J. Chem. Phys. , 100 : 387
- Cheng , B-M , Eberhard , J , Chen , W-C and Yu , C-H . 1997 . J. Chem. Phys. , 106 : 9727
- Quandt , RW , Wang , X , Tsukiyama , K and Bershon , R . 1997 . Chem. Phys. Lett. , 276 : 122
- Schurath , U , Weber , M and Becker , KH . 1997 . J. Chem. Phys. , 67 : 110
- Kakimoto , M , Saito , S and Hirota , E . 1980 . J. Mol. Spectrosc. , 80 : 334
- Endo , Y , Saito , S and Hirota , E . 1981 . J. Chem. Phys. , 75 : 4379
- Ohashi , N , Kakimoto , M , Saito , S and Hirota , E . 1980 . J. Mol. Spectrosc. , 84 : 204
- Kawasaki , M , Kasatani , K and Sato , H . 1980 . Chem. Phys. Lett. , 75 : 128
- Sears , TJ and McKellar , ARW . 1983 . Mol. Phys. , 49 : 25
- Webster , CR , Brucat , PR and Zane , RN . 1982 . J. Mol. Spectrosc. , 92 : 184
- Balucani , N , Casavecchia , P , Stranges , D and Volpi , GG . 1993 . Chem. Phys. Lett. , 211 : 469
- Balucani , N , Stranges , D , Casavecchia , P and Volpi , GG . 2004 . J. Chem. Phys. , 120 : 9571
- Slagle , IR , Baiocchi , F and Gutman , D . 1978 . J. Phys. Chem. , 82 : 1333
- Davidson , FE , Clemo , AR , Duncan , DL , Browet , RJ , Hobson , JH and Grice , R . 1982 . Mol. Phys. , 46 : 33
- Iraqi , M and Schwarz , H . 1994 . Chem. Phys. Lett. , 221 : 359
- Lee , Y-Y , Peen , Y-P and Wang , NS . 1994 . J. Chem. Phys. , 100 : 387
- O’Hair , RAJ , DePuy , CH and Bierbaum , VM . 1993 . J. Phys. Chem. , 97 : 7955
- Benson , SW . 1978 . Chem. Rev. , 78 : 23
- Xantheas , SS and Dunning , TH . 1993 . J. Phys. Chem. , 97 : 18
- Xantheas , SS and Dunning , TH . 1993 . J. Phys. Chem. , 97 : 6616
- Esseffar , M , Mo , O and Yañez , M . 1994 . J. Chem. Phys. , 101 : 128
- Wilson , C and Hirst , DM . 1994 . J. Chem. Soc. Faraday Trans. , 90 : 3051
- Luke , BT and Mclean , AD . 1985 . J. Phys. Chem. , 89 : 4592
- Gourmi , A , Laakso , D , Smith , CE , Rocha , J-D and Marshall , P . 1995 . J. Chem. Phys. , 102 : 161
- Denis , PA and Ventura , ON . 2000 . Int. J. Quant. Chem. , 80 : 439
- Denis , PA . 2005 . Chem Phys. Lett. , 402 : 289
- Badenes , MP , Tucceri , ME and Cobos , CJ . 2000 . Z. Phys. Chem. , 214 : 1193
- Wilson , AK and Dunning , TH . 2004 . J. Phys. Chem. A , 108 : 3129
- Wang , NX and Wilson , AK . 2005 . J. Phys. Chem. A , 109 : 7187
- Decker , BK , Adams , NG , Babcock , LM , Crawford , TD and Schaefer , HF . 2000 . J. Phys. Chem. A , 104 : 4636
- Vervisch , L , Labegorre , B and Reveillon , J . 2004 . Fuel , 83 : 605
- Moore Plumer , PL . 1990 . J. Chem. Phys. , 92 : 6627
- Martinez-Nuñez , E and Varandas , AJC . 2001 . J. Phys. Chem. A , 105 : 5923
- Perez-Juste , I and Carballeira , L . 2007 . J. Mol. Struct. Theochem , 855 : 27
- Martinez-Nuñez , E , Vazquez , SA and Varandas , AJC . 2002 . Phys. Chem. Chem. Phys. , 4 : 279
- Li. , B-T , Wei , Z-Z , Zhang , H-Z and Sun , C-C . 2006 . J. Phys. Chem. A , 110 : 10643
- Grant , DJ , Dixon , DA , Francisco , JS , Feller , D and Peterson , KA . 2009 . J. Phys. Chem. A113 , : 11343
- Steudel , R , Steudel , Y and Phys. , YJ . 2010 . Chem. A , 114 : 4437
- Denis , PA . 2009 . Spectrochim. Acta Part A , 72 : 720
- Denis , PA . 2006 . Chem. Phys. Lett. , 422 : 434
- Denis , PA . 2008 . J. Sulf. Chem. , 29 : 327
- Denis , PA . 2004 . J. Phys. Chem. A , 108 : 11092
- Denis , PA . 2005 . J. Chem. Theory and Comp. , 1 : 900
- Denis , PA and Faccio , R . 2008 . Chem. Phys. Lett. , 460 : 486
- Denis , PA . 2009 . Int. J. Quant. Chem. , 109 : 772
- Denis , PA . 2008 . Mol. Phys. , 106 : 2557
- Denis , PA . 2010 . Mol. Phys. , 108 : 171
- Ornellas , FR . 2007 . J. Chem. Phys. , 126 : 204314
- Ornellas , FR . 2007 . Chem. Phys. Lett. , 448 : 24
- Ornellas , FR . 2008 . Chem. Phys. Lett. , 344 : 95
- Peebles , LR and Marshall , P . 2002 . J. Chem. Phys. , 117 : 3132
- Peebles , LR and Marshall , P . 2002 . Chem. Phys. Lett. , 366 : 520
- Ashworth , SH and Fink , EH . 2007 . Mol. Phys. , 105 : 715
- Prascher , BP and Wilson , AK . 2007 . Mol. Phys. , 105 : 2899
- Edhay , B , Lahmar , S , Lakhdar , ZB and Hochlaf , M . 2007 . Mol. Phys. , 105 : 1115
- Beckers , H , Esser , S , Metzroth , T , Behnke , M , Willner , H , Gauss , J and Hahn , J . 2006 . Chem. Eur. J. , 12 : 832
- Behnke , M , Suhr , J , Thorwirth , S , Lewen , F , Lichau , H , Hahn , J , Gauss , J , Yamada , Koichi MT and Winnewisse , G . 2008 . J. Mol. Spectrosc. , 221 : 121
- Baum , O , Esser , S , Gierse , N , Brunken , S , Lewel , F , Hahn , J , Gauss , J , Schelmmer , S and Giesen , TF . 2006 . J. Mol. Struct. , 795 : 256
- Baum , O , Giesen , TF and Schelmmer , S . 2008 . J. Mol. Spectrosc. , 247 : 25
- Cubbage , JW and Jenks , WS . 2001 . J. Phys. Chem. A , 105 : 10588
- Gomes , JRB and Gomes , P . 2005 . Tetrahedron , 61 : 2705
- Montoya , A , Sendt , K and Haynes , BS . 2005 . J. Phys. Chem. A , 109 : 1057,
- Yurchenko , S , Yachmenev , A , Thiel , W , Baum , O , Giesen , TF , Melnikov , VV and Jensen , P . 2009 . J. Mol. Spectrosc. , 257 : 57
- Feller , D , Peterson , KA and Dixon , DA . 2009 . J. Chem. Phys. , 129 : 204105
- Raghavarchari , K , Trucks , GW , Pople. , JA and Head Gordon , M . 1989 . Chem. Phys. Lett. , 157 : 479
- Stanton , JF . 1997 . Chem. Phys. Lett. , 281 : 130
- Bartlett , RJ , Watts , JD , Kucharski , SA and Noga , J . 1990 . Chem. Phys. Lett. , 165 : 513
- Lee , TJ and Rendell , AP . 1991 . J. Chem. Phys. , 94 : 6229
- Dunning , TH Jr , Peterson , KA and Wilson , AK . 2001 . J. Chem. Phys. , 114 : 9244
- Peterson , KA and Dunning , TH . 2002 . J. Chem. Phys. , 117 : 10548
- Halkier , A , Helgaker , T , Jorgensen , P , Klopper , W , Koch. , H , Olsen , J and Wilson , AK . 1998 . Chem. Phys. Lett. , 286 : 242
- CFOUR, a quantum chemical program package written by J.F. Stanton, J. Gauss, M.E.Harding, P.G. Szalay with contributions from A.A. Auer, R.J. Bartlett, U. Benedikt, C. Berger, D.E. Bernholdt, Y.J. Bomble, O. Christiansen, M. Heckert, O. Heun, C. Huber, T.-C. Jagau, D. Jonsson, J. Jusélius, K. Klein, W.J. Lauderdale, D.A. Matthews, T. Metzroth, D.P. O'Neill, D.R. Price, E. Prochnow, K. Ruud, F. Schiffmann, S. Stopkowicz, J. Vázquez, F. Wang, J.D. Watts and the integral packages MOLECULE (J. Almlöf and P.R. Taylor), PROPS (P.R. Taylor), ABACUS (T. Helgaker, H.J. Aa. Jensen, P. Jørgensen, and J. Olsen), and ECP routines by A. V. Mitin and C. van Wüllen. For the current version, see http://www.cfour.de
- Basis sets were obtained from the Extensible Computational Chemistry Environment Basis Set Database, Version 7/30/02, as developed and distributed by the Molecular Science Computing Facility, Environmental and Molecular Sciences Laboratory which is part of the Pacific Northwest Laboratory, P.O. Box 999, Richland, Washington 99352, USA, and funded by the U.S. Department of Energy. The Pacific Northwest Laboratory is a multi-program laboratory operated by Battelle Memorial Institute for the U.S. Department of Energy under contract DE-AC06-76RLO 1830. Contact David Feller or Karen Schuchardt for further information.
- CE Moore, Atomic Energy Levels, U.S. National Bureau of Standards Circular, Vol. 37 (NBS, Washington DC, 1991).
- Mills , I . 1972 . Molecular Spectroscopy: Modern Research , Edited by: Rao , KN and Mathews , CW . 115 New York : Academic Press .
- MRCC, a string-based quantum chemical program suite written by M. Kállay. For the current version see www.mrcc.hu.
- Kállay , M and Surján , PR . 2001 . J. Chem. Phys. , 115 : 2945
- Coriani , S , Marchesan , D , Gauss , J , Hatting , C , Helgaker , T and Jorgensen , P . 2005 . J. Chem. Phys. , 123 : 184107