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전체 ㅣ A B C D E F G H I J K L M N O P Q R S T U V W X Y Z ㅣ 가 나 다 라 마 바 사 아 자 차 카 타 파 하 기타

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12/2146 페이지

제한항목: 1997

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검색리스트 테이블
No	서명	저자	발행처	원문제공시작년
221	Ab initio calculations and quantum statistical analysis of the SiH~3+NO reaction	Nguyen, M. T. Sengupta, D.	North Holland	1997

222	Ab-initio calculations for 3d impurities on Fe(001) and Ni(001)	Nonas, B	North-Holland Pub. Co	1997

223	Ab initio calculations of the anionic sodium-ammonia complex	Ritze, H.-H.	North Holland	1997

224	Ab initio calculations of the interlayer exchange coupling of Fe-/Co-/Ni-layers in Cu(100)	Wildberger, K	North-Holland Pub. Co	1997

225	Ab initio calculations of the structures and energies of gas phase isomeric C~3N~4 molecules	BelBruno, J. J.	North Holland	1997

226	Ab initio calculations of the vibrational contributions to the static dipole polarizability of CO~2 and CS~2	Blain, M. Bras, N. Leclercq, J.-M. Guerreiro, M.	North Holland	1997

227	Ab initio calculations of vibronic coupling. Applications to symmetry-forbidden vibronic spectra and internal conversion in ethylene	Hayashi, M. Mebel, A. M. Lin, S. H.	North Holland	1997

228	Ab initio CASSCF and MRSDCI calculations of the (C~6H~6)^+~2 radical	Sumi, T. Miyoshi, E. Sakai, Y. Ichikawa, T.	North Holland	1997

229	Ab initio computational study of the interaction of Cl atoms with HI, CH~3I and CH~3OCH~2I	Papagiannakopoulos, P. Lazarou, Y. G. Kambanis, K. G.	North Holland	1997

230	Ab initio gradient corrected density functional molecular dynamics: investigation of structural and dynamical properties of the Li~8 cluster	Reichardt, D	North Holland	1997

231	Ab initio infrared spectrum of liquid water	Bernasconi, M. Parrinello, M. Silvestrelli, P. L.	North Holland	1997

232	Ab initio investigations of the electronic structure of HeCH^+ and HeCH^2^+	Hughes, J. M. Von Nagy-Felsobuki, E. I.	North Holland	1997

233	Ab initio molecular dynamics around a conical intersection: Li(2p) + H~2	Martinez, T. J.	North Holland	1997

234	Ab initio molecular dynamics of ion solvation. The case of Be^2^+ in water	Sprik, M. Marx, D. Parrinello, M.	North Holland	1997

235	Ab initio molecular dynamics of pseudorotating Li~5	Carter, E. A. Gibson, D. A.	North Holland	1997

236	Ab initio molecular dynamics simulation of methanol adsorbed in chabazite	Sauer, J. Hutter, J. Haase, F.	North Holland	1997

237	Ab initio molecular orbital calculation of the second hyperpolarizability of the carbon disulfide molecule: electron correlation and frequency dispersion	Ohta, K. Sakaguchi, T. Fukumi, T. Kamada, K.	North Holland	1997

238	Ab initio molecular orbital model of scanning tunneling microscopy. Benzene and benzene adsorbed on a Ag surface	Nakatsuji, H. Hidaka, M. Fujita, T. Nakai, H.	North Holland	1997

239	Ab initio molecular orbital study of excited electronic states of the vinyl radical	Chen, Y.-T. Mebel, A. M. Lin, S.-H.	North Holland	1997

240	Ab initio molecular orbital study on the H~2 loss reaction from ethane cation, C~2H^+~6	Kurosaki, Y	North Holland	1997

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