共 50 条
- [21] Ab initio molecular orbital calculations and visualizations on the PC ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 1996, 211 : 95 - COMP
- [22] SIMPLIFIED AB-INITIO CALCULATIONS FOR MOLECULAR SYSTEMS THEORETICA CHIMICA ACTA, 1970, 18 (02): : 98 - &
- [23] Organic radicals in molecular magnetic materials. ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2000, 219 : U774 - U774
- [25] Ab initio molecular orbital calculations on silica rings Journal of Non-Crystalline Solids, 1999, 255 (02): : 163 - 170
- [27] Molecular mechanics and ab initio calculations on cyclopentadienyl cations J. Comput. Chem., 12 (1402-1420):
- [28] Ab-initio calculation of mechanical and thermo-mechanical materials. ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2000, 220 : U192 - U192
- [29] Ab initio calculations of intermolecular interaction potentials of fullerene-fragments systems JOURNAL OF THEORETICAL & COMPUTATIONAL CHEMISTRY, 2005, 4 (01): : 49 - 58