ab initio calculations of ionic and hydrogen bonding interactions with the OCN^-, SCN^- and SeCN^- anions

References

• Rannou , J. and Chabanel , M. 1980 . J. Chim. phys. , 77 : 201
   Google Scholar
• Chabanel , M. and Wang , Z. 1984 . J. phys. Chem. , 88 : 1441
   Google Scholar
• Chabanel , M. and Bencheikh , A. 1989 . J. Chem. Soc. Dalton Trans , : 2193
   Google Scholar
• Bacelon , P. , Corset , J. and de Loze , C. 1980 . J. Solution Chem. , 9 : 129
   Google Scholar
• Paoli , D. and Chabanel , M. 1991 . J. chem. Res. , : 360
   Google Scholar
• Rannou , J. , Masse , G. and Chabanel , M. 1978 . C.r. Acad. Sci. Paris , : 93
   Google Scholar
• Rannou , J. and Chabanel , M. 1980 . J. Chim. phys. phys.-chim. Biol. , 77 : 201
   Google Scholar
• Paoli , D. , Lucon , M. and Chabanel , M. 1978 . Spectrochim. Acta A , 34 : 1087
   Google Scholar
• Gans , P. , Gill , J. B. and Fearnley , D. P. 1981 . J. chem. Soc. Dalton Trans , : 1708
   Google Scholar
• Chabanel , M. 1990 . Pure appl. Chem. , 62 : 35
   Google Scholar
• Mamanatov , G. and Popov , A. I. 1994 . Chemistry of Nonaqueous Solutions : Current Press , New York : VCH Publishers . Chap. 2
   Google Scholar
• Golub , A. M. , Köhler , H. and Skopenko , V. V. 1986 . Chemistry of Pseudohalides , Amsterdam : Elsevier .
   Google Scholar
• Karitonov , Y. Y. , Tsintsadze , G. V. and Porai-Koshits , M. A. 1965 . Russ. J. inorg. Chem. , 10 : 427
   Google Scholar
• Nakamoto , K. 1978 . IR and Raman Spectra of Inorganic and Coordination Compounds , New York : Wiley .
   Google Scholar
• Squalli , O. , Martins Costa , M. C. , Cartier , A. and Chabanel , M. 1994 . J. molec. Struct. Theochem. , 303 : 11
   Google Scholar
• Liu , B. and McLean , J. 1980 . J. chem. Phys. , 72 : 3418
   Web of Science ®Google Scholar
• Feynmann , R. 1939 . Phys. Rev. , 56 : 340
   Google Scholar
• Berlin , T. 1951 . J. chem. Phys. , 19 : 208
   Web of Science ®Google Scholar
• Bader , R. F. W. 1994 . Atoms in Molecules : A Quantum Theory , Oxford : Clarendon Press .
   Google Scholar
• Howard , S. T. 1995 . Molec. Phys. , 85 : 395
   Web of Science ®Google Scholar
• Devore , T. C. 1987 . J. molec. Struct. , 162 : 273
   Google Scholar
• Bachelin , M. , Gans , P. and Gill , J. B. 1992 . J. chem. Soc. Faraday Trans , 88 : 3327
   Google Scholar
• Bacelon , P. , Corset , J. and de Loze , C. 1983 . J. Solution Chem. , 12 : 13
   Google Scholar
• Brooker , M. H. and Wen , N. 1993 . Can. J. Chem. , 71 : 1764
   Web of Science ®Google Scholar
• Kameda , Y. , Takahashi , R. and Usuki , U. 1994 . Bull. chem. Soc., Jap. , 67 : 956
   Google Scholar
• Kuhn , L. and Bowman , R. 1967 . Spectrochim. Acta A , 23 : 189
   Google Scholar
• Probst , M. 1994 . Int. J. Quant. Chem. Symp. , 28 : 553
   Google Scholar
• Parrini , F. and Morales , R. 1993 . J. molec. Struct. Theochem. , 282 : 59
   Google Scholar
• Cai , Z.-L. 1983 . Chem. Phys. , 170 : 33
   Google Scholar
• Baranovskii , V. I. , Sizova , O. V. , Invanova , N. V. and Ermolaeva , T. T. 1986 . Z. strukt. Khim. , 27 : 9
   Google Scholar
• Perelygin , I. S. and Shatokhin , S. A. 1990 . Z. strukt, Khim. , 31 : 886
   Google Scholar
• Pyykko , P. and Zhao , Y. 1990 . J. phys. Chem. , 94 : 7753
   Google Scholar
• Yu , D. , Rauk , A. and Armstrong , D. 1992 . J. phys. Chem. , 96 : 6031
   Web of Science ®Google Scholar
• Frisch , M. , Trucks , G. , Schlegel , H. , Gill , P. , Johnson , B. , Wong , M. , Foresman , J. , Robb , M. , Head-Gordon , M. , Replogle , E. , Gomperts , R. , Andres , J. , Raghavachari , K. , Binkley , J. , Gonzalez , C. , Martin , R. , Fox , D. , Defrees , D. , Baker , J. , Stewart , J. and Pople , J. 1993 . Gaussian 92/DFT, Revision F.3 , Pittsburgh, PA : Gaussian Inc .
   Google Scholar
• Dunning , T. H. and Hay , P. J. 1976 . Modern Theoretical Chemistry , New York : Plenum Press .
   Google Scholar
• Hehre , W. J. , Ditchfield , R. and Pople , J. A. 1972 . J. chem. Phys. , 56 : 2257
   Web of Science ®Google Scholar
• Poirer , R. , Kari , R. and Csizmadia , I. G. 1985 . Handbook of Gaussian Basis Sets , Amsterdam : Elsevier .
   Google Scholar
• Wachters , A. 1970 . J. chem. Phys. , 52 : 1033
   Web of Science ®Google Scholar
• Gianolo , L. , Pavani , R. and Clementi , E. 1978 . Chim. Ital. , 108 : 181
   Google Scholar
• Sakai , Y. , Tatewaki , H. and Huzinaga , S. 1982 . J. comput. Chem. , 2 : 278
   Google Scholar
• Huzinaga , S. 1965 . J. chem. Phys. , 42 : 1293
   Web of Science ®Google Scholar
• Glendening , E. , Reed , A. , Carpenter , J. and Weinhold , F. NBO Version 3.1
   Google Scholar
• Pepke , E. , Murray , J. , Lyons , J. and Hwu , T.-Y. Supercomputer Computation Research Institute at Florida State University
   Google Scholar
• Colthup , N. B. , Daly , L. H. and Wiberley , S. E. 1990 . Introduction to Infrared and Raman Spectroscopy , Orlando : Academic Press .
   Google Scholar
• Badger , R. 1934 . J. chem. Phys. , 2 : 128
   Google Scholar
• Schultz , P. W. , Leroi , G. E. and Popov , A. I. 1995 . J. Amer. chem. Soc. , 117 : 10735
   Google Scholar
• Schultz , P. W. , Leroi , G. E. and Popov , A. I. 1996 . J. Amer. chem. Soc. , submitted
   Google Scholar