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Molecular Physics
An International Journal at the Interface Between Chemistry and Physics
Volume 101, 2003 - Issue 1-2
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Original Articles

Theoretical study of the TiC molecule: clarification of the ground state

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Pages 111-116 | Received 01 Dec 2001, Accepted 06 Jun 2002, Published online: 25 Nov 2009

References

  • Harrison , J. F. 2000 . Chem. Rev. , 100 : 679
  • Shim , I. and Gingerich , K. A. 1999 . Chem. Phys. Lett. , 303 : 87
  • Shim , I. and Gingerich , K. A. 1992 . Intl. J. Quantum Chem. , 42 : 349 Maclagan, R. G. A., and Scuseria, G. E., 1997, J. chem. Phys. 106, 1491
  • Mattar , S. M. 1993 . J. phys. Chem. , 97 : 3171
  • Bauschlicher , C. W. Jr. and Siegbahn , P. E. M. 1984 . Chem. Phys. Lett. , 104 : 331
  • Hack , M. D. , Maclagan , R. G. A. , Scuseria , G. E. and Gordon , M. S. 1996 . J. chem. Phys. , 104 : 6628
  • Gingerich , K. A. 1969 . J. chem. Phys. , 50 : 2255
  • Kohl , F. J. and Stearns , C. A. 1974 . High Temp. Sci. , 6 : 284
  • Gupta , S. K. and Gingerich , K. A. 1980 . High Temp. high Press. , 12 : 273
  • Tanaka , K. , Sakai , T. and Terashima , H. 1989 . Theoret. Chim. Acta , 76 : 213 (a);(b) Sakai, T., and Tanaka, K., 1993, Theoret. Chim Acta 85, 451;(c) Tanaka, K., Ghosh, T. K., and Sakai, K., 1999, Intl. J. Quantum Chem. 74, 661;(d) Tanaka, K., Sakai, T., and Mochizuki, Y., 1999, Recent Advance in Computational Chemistry, Vol. 4, edited by K. Hirao (Singapore: World Scientific) p. 95
  • Tanaka , K. and Mochizuki , Y. 1997 . Theoret. Chem. Accounts , 98 : 165
  • Tomonari , M. , Mochizuki , Y. and Tanaka , K. 1999 . Theoret. Chem. Accounts , 101 : 332
  • Tomonari , M. and Tanaka , K. 2001 . Theoret. Chem. Accounts , 106 : 188
  • Mochizuki , Y. and Tanaka , K. 1998 . Theoret. Chem. Accounts , 99 : 88
  • Tanaka , K. , Sekiya , M. and Yoshimine , M. 2001 . J. chem. Phys. , 115 : 4558
  • Bauschlicher , C. W. Jr. , Partridge , H. , Langhoff , S. R. and Rosi , M. 1991 . J. chem. Phys. , 95 : 1057
  • Bauschlicher , C. W. Jr. , Langhoff , S. R. and Komornicki , A. 1990 . Theoret. Chim. Acta , 77 : 263
  • Bauschlicher , C. W. Jr. and Maitre , P. 1995 . Theoret. Chim. Acta , 90 : 189
  • Moore , C. E. 1949 . Atomic Energy Levels, US Natl. Bur. Stand. Circ. No 467 Washington, DC : NIST .
  • Bauschlicher , C. W. Jr. , Walch , S. P. and Partridge , J. 1982 . J. chem. Phys. , 76 : 1033
  • Bar , M. and Ahlrichs , R. 1991 . Chem. Phys. Lett. , 178 : 241
  • Bauschlicher , C. W. Jr. , Langhoff , S. R. and Partridge , H. 1994 . J. chem. Phys. , 100 : 1219
  • Basis sets were obtained from the Extensible Computational Chemistry Environment Basis Set Database, Version 1.0, available at http://emsp.pnl.gov:2080/forms/basisform.html
  • Schaefer , A. , Horn , H. and Ahlrichs , R. 1992 . J. chem. Phys. , 97 : 2571
  • Hay , P. J. 1977 . J. chem. Phys. , 66 : 4377
  • Wachters , A. J. H. 1970 . J. chem. Phys. , 52 : 1033 Bauschlicher Jr., C. W., Langhoff, S. R., and Barnes, L. A., 1989, J. chem. Phys. 91, 2399
  • Mochizuki , Y. and Tanaka , K. 1997 . Chem. Phys. Lett. , 274 : 264
  • Woon , D. E. and Dunning , T. H. Jr. 1993 . J. chem. Phys , 98 : 1358
  • Langhoff , S. R. and Davidson , E. R. 1974 . Intl. J. Quantum. Chem. , 8 : 61 Davidson, E. R., and Silver, D. W., 1979, Chem. Phys. Lett. 52, 403
  • Lengsfield , B. H. III . 1980 . J. chem. Phys. , 73 : 382 Lengsfield III, B. H., and Liu, B., 1981, J. chem. Phys. 75, 478;Liu, B., and Yoshimine, M., 1981, J. chem. Phys. 74, 612

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