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101 저널기사 Ab initio adiabatic and diabatic permanent dipoles for the low-lying states of the LiH molecule. A direct illustration of the ionic character 미리보기
Gadea, F. X. Berriche, H. North Holland 1995
102 저널기사 Ab initio and density functional study of the 5-pentacyclo(6.2.1.13,6.02,7.04,10)dodecyl cation. A symmetrical (micro)-hydride bridged carbocation/ 미리보기
Carneiro, Jos� Walkimar de M North Holland 2001
103 저널기사 Ab initio and density functional study of the Jahn-Teller distortion in the silane radical cation 미리보기
De Proft, F. Geerlings, P. North Holland 1996
104 저널기사 Ab initio and DFT studies for accurate description of van der Waals interaction between He atoms/ 미리보기
Kurita, Noriyuki North Holland 2001
105 저널기사 Ab initio and DFT studies of the weakly bound nitrogen molecule complexes (N2)n (n=3-6)/ 미리보기
Li, Q North Holland 2003
106 저널기사 Ab initio and DFT study of molecular structure and tautomerism of 2-amino-2-imidazoline, 2-amino-2-oxazoline and 2-amino-2-thiazoline/ 미리보기
Remko, Milan North Holland 2001
107 저널기사 Ab initio and DFT study of the ground 3A' potential energy surface for the O(3P)+N2O->2NO reaction/ 미리보기
Gonz�lez, Miguel North Holland 2001
108 저널기사 Ab initio and model investigation of acetylene clustering around hydrogen cyanide/ 미리보기
Schroeder, W. P North Holland 2003
109 저널기사 Ab initio and model investigation of acetylene clustering around hydrogen cyanide/ 미리보기
Schroeder, W. P North Holland 2003
110 저널기사 Ab initio anharmonic intermolecular potential of the C2H2-HCl hydrogen bonded complex/ 미리보기
�ar�abal, P North Holland 2001
111 저널기사 Ab initio basis set and correlation limit interaction energies for He-He, He-H2, and H-H2/ 미리보기
Lee, Jae Shin North Holland 2001
112 저널기사 Ab initio calculation of ^2H quadrupole coupling constants in molecular crystals: application to polymorphs of oxalic acid dihydrate 미리보기
Camus, S. Harris, K. D. M. Johnston, R. L. North Holland 1997
113 저널기사 Ab initio calculation of atomic axial tensors and vibrational rotationalstrengths using density functional theory 미리보기
Cheeseman, J. R. Frisch, M. J. Stephens, P. J. Devlin, F. J. North Holland 1996
114 저널기사 Ab initio calculation of Auger spectra for carbon monoxide 미리보기
Schimmelpfennig, B. Peyerimhoff, S. D. North Holland 1996
115 저널기사 Ab initio calculation of excited state energies using basis set optimization and open-shell Moeller-Plesset perturbation theory 미리보기
Glushkov, V. N. Tsaune, A. Y. North Holland 1996
116 저널기사 Ab initio calculation of resonance energies and widths of HOCl(7nOH and 8nOH) and comparison with experiment/ 미리보기
Zou, Shengli North Holland 2001
117 저널기사 Ab initio calculation of the a3S+u interaction potential and vibrational levels of 7Li2/ 미리보기
Halls, M D North Holland 2001
118 저널기사 Ab initio calculation of the anharmonic force and dipole fields of nitrogen trifluoride 미리보기
Palmieri, P. Willetts, A. Senent, M. L. Tarroni, R. North Holland 1996
119 저널기사 Ab initio calculation of the electrical properties of the X^2cap pi~g ground state of O~2^+ 미리보기
Feher, M. Martin, P. A. North Holland 1996
120 저널기사 Ab initio calculation of the torsional potential for 2-alkenylanthracene in the ground and excited states/ 미리보기
Sakata, Ken North Holland 2001
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