Articles dans des revues avec comité de lecture (96)
  1. 13. De Mare, G., & Panchenko, Y. (2006). Ab initio vibrational analysis of hexafluoroethane C2F 6. Journal of structural chemistry, 47(2), 232-240. doi:10.1007/s10947-006-0291-y
  2. 14. Panchenko, Y., Bock, C., & De Mare, G. (2005). Some aspects of scaling factor calculations for quantum-mechanical molecular force fields. Journal of structural chemistry, 46(1), 49-58. doi:10.1007/s10947-006-0008-2
  3. 15. Panchenko, Y., & De Mare, G. (2005). Scaling the quantum mechanical molecular force field vs. solving the inverse vibrational problem. Moscow University chemistry bulletin, 60(1), 1-15.
  4. 16. Panchenko, Y., De Mare, G., Abramenkov, A., Baird, M., Tverezovsky, V., Nizovtsev, A., & Bolesov, I. (2004). Vibrational spectra and ab initio analysis of tert-butyl, trimethylsilyl, and trimethylgermyl derivatives of 3,3-dimethylcyclopropene VI: Application of observed trends to stannyl derivatives. Spectrochimica acta. Part A: Molecular and biomolecular spectroscopy, 60(11), 2511-2516. doi:10.1016/j.saa.2003.12.044
  5. 17. De Mare, G., Panchenko, Y., Abramenkov, A., Baird, M., Tverezovsky, V., Nizovtsev, A., & Bolesov, I. (2004). Vibrational spectra and ab initio analysis of tert-butyl, trimethylsilyl, and trimethylgermyl derivatives of 3,3-dimethyl cyclopropene V. 3,3-Dimethyl-1-(trimethylgermyl)cyclopropene. Spectrochimica acta. Part A: Molecular and biomolecular spectroscopy, 60(3), 519-526. doi:10.1016/S1386-1425(03)00257-9
  6. 18. Moussaoui, Y., Ouamerali, O., & De Mare, G. (2003). Properties of the phosphorus oxide radical, PO, its cation and anion in their ground electronic states: Comparison of theoretical and experimental data. International reviews in physical chemistry, 22(4), 641-675. doi:10.1080/01442350310001617011
  7. 19. Panchenko, Y., De Mare, G., Abramenkov, A., Baird, M., Tverezovsky, V., Nizovtsev, A., & Bolesov, I. (2003). Vibrational spectra and ab initio analysis of tert-butyl, trimethylsilyl, and trimethylgermyl derivatives of 3,3-dimethylcyclopropene II. 3,3-dimethyl-1,2-bis(trimethylsilyl)cyclopropene. Spectrochimica acta. Part A: Molecular and biomolecular spectroscopy, 59(9), 2087-2098. doi:10.1016/S1386-1425(03)00018-0
  8. 20. De Mare, G., Panchenko, Y., Abramenkov, A., Baird, M., Tverezovsky, V., Nizovtsev, A., & Bolesov, I. (2003). Vibrational spectra and ab initio analysis of tert-butyl, trimethylsilyl, and trimethylgermyl derivatives of 3,3-dimethylcyclopropene III. 3,3-dimethyl-1-(trimethylsilyl)cyclopropene. Spectrochimica acta. Part A: Molecular and biomolecular spectroscopy, 59(9), 2063-2072. doi:10.1016/S1386-1425(03)00012-X
  9. 21. Panchenko, Y., De Mare, G., Abramenkov, A., Baird, M., Tverezovsky, V., Nizovtsev, A., & Bolesov, I. (2003). Vibrational spectra and ab initio analysis of tert-butyl, trimethylsilyl, and trimethylgermyl derivatives of 3,3-dimethylcyclopropene IV. 3,3-dimethyl-1,2-bis(trimethylgermyl)cyclopropene. Spectrochimica acta. Part A: Molecular and biomolecular spectroscopy, 59(8), 1733-1744. doi:10.1016/S1386-1425(02)00399-2
  10. 22. De Mare, G., Panchenko, Y., & Abramenkov, A. (2003). Ab initio spectrograms of the molecular vibrational spectrum. Russian chemical bulletin, 52(4), 817-822. doi:10.1023/A:1024475620533
  11. 23. Panchenko, Y., Vander Auwera, J., De Mare, G., & Moussaoui, Y. (2003). Predictive Abilities of Scaled Quantum Mechanical Molecular Force Fields: Application to 1,3-Butadiene. Structural chemistry, 14(4), 337-348. doi:10.1023/A:1024445810013
  12. 24. Panchenko, Y., & De Mare, G. (2003). Vibrational spectra and ab initio analysis of tert-butyl, trimethylsilyl, and trimethylgermyl derivatives of 3,3-dimethylcyclopropene. I. 3,3-Dimethyl-1,2-bis(tert-butyl)cyclopropene. Spectrochimica acta. Part A: Molecular and biomolecular spectroscopy, 59(2), 329-334. doi:10.1016/S1386-1425(02)00149-X
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