1.标题：Density-functional calculations of the nuclear magnetic shielding and indirect nuclear spin-spin coupling constants of three isomers of C20 作者：Lutnaes OB (Lutnaes, Ola B.)1, Helgaker T (Helgaker, Trygve)1, Jaszunski M (Jaszunski, Michal） 来源出版物: MOLECULAR PHYSICS 卷: 106 期: 20 页: 2357-2365 连接：http://www.informaworld.com/smpp/content~db=all?content=10.1080/00268970802467994
2.标题：Ab initio molecular dynamics study of aqueous formaldehyde and methanediol 作者：Mugnai M (Mugnai, M.)2,3, Cardini G (Cardini, G.)2,3, Schettino V (Schettino, V.)2,3, Nielsen CJ (Nielsen, C. J.) 来源出版物: MOLECULAR PHYSICS 卷: 105 期: 17-18 页: 2203-2210 连接：http://www.informaworld.com/smpp/content~db=all?content=10.1080/00268970701513864
3.标题：Infrared and Raman spectra, conformations, ab initio calculations and spectral assignments of 1,3-disilabutane (SiH3CH2SiH2CH3) 作者：Guirgis GA (Guirgis, Gamil A.), Mazzone PM (Mazzone, Paul M.), Pasko DN (Pasko, Daniel N.), Klaeboe P (Klaeboe, Peter), Horn A (Horn, Anne), Nielsen CJ (Nielsen, Claus J.) 来源出版物: JOURNAL OF RAMAN SPECTROSCOPY 卷: 38 期: 9 页: 1159-1173 连接：http://www3.interscience.wiley.com/journal/114229274/abstract?CRETRY=1&SRETRY=0
4.标题：Raman spectra, ab initio calculations, phase transitions and conformations of 1,3-disilabutane 作者：Horn A (Horn, A.), Klaeboe P (Klaeboe, P.), Nielsen CJ (Nielsen, C. J.), Mazzone PM (Mazzone, P. M.), Pasko DN (Pasko, D. N.), Guirgis GA (Guirgis, G. A.) 来源出版物: PHASE TRANSITIONS 卷: 80 期: 6-7 页: 529-538 连接：http://www.informaworld.com/smpp/content~db=all?content=10.1080/01411590701339435
5.标题：Structure and stability of networked metallofullerenes of the transition metals 作者：Sparta M (Sparta, Manuel), Borve KJ (Borve, Knut J.), Jensen VR (Jensen, Vidar R.) 来源出版物: JOURNAL OF PHYSICAL CHEMISTRY A 卷: 110 期: 41 页: 11711-11716 连接：http://pubs.acs.org/doi/abs/10.1021/jp064071h
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