Tables of Contents service for
CHEMICAL PHYSICS LETTERS
Volume 246, Issue 1-2, 17 November 1995
- Ab initio calculation and display of the rotatory strength tensor in the random phase approximation. Method and model studies
Pedersen, T.B. and Hansen, A.E.
page 1-8
- Conformational analysis of n-alkanes using density functional theory. Comparison with ab initio calculations
Tsuzuki, S., Uchimaru, T. and Tanabe, K.
page 9-12
- Theoretical study of water clusters: octamer
Jensen, J.O., Krishnan, P.N. and Burke, L.A.
page 13-19
- Theoretical study of structure and thermodynamic properties of YC2
Roszak, S. and Balasubramanian, K.
page 20-25
- Lowest unoccupied molecular orbital as the resonant orbital. An investigation using the bi-variational self-consistent field method
Medikeri, M.N. and Mishra, M.K.
page 26-32
- The dissociation energies of AlH2 and AlAr
Partridge, H., Bauschlicher, C.W. Jr. and Visscher, L.
page 33-39
- A comparison of the accuracy of different functionals
Bauschlicher, C.W. Jr.
page 40-44
- Methyl addition to acetylene and ethylene from a density functional approach
Barone, V. and Orlandini, L.
page 45-52
- ESR features of the bicyclobutyl radical revisited. A counterintuitive ordering of short- and long-range isotropic hyperfine coupling constants
Barone, V., Adamo, C., Grand, A. and Subra, R.
page 53-58
- Ab initio predictions of the lowest electronic states, structures vibrational frequencies of phenylphosphinidene
Hamilton, T.P., Willis, A.G. and Williams, S.D.
page 59-65
- AM1 computations on seven isolated-pentagon-rule isomers of C80
Mei-Ling, S., Slanina, Z., Shyi-Long, L., Uhlik, F. and Adamowicz, L.
page 66-72
- Orbital mixing in CO chemisorption on transition metal surfaces
P., H., King, D.A., M.-H., L. and Payne, M.C.
page 73-78
- Selective ion desorption in ESD from physisorbed CO/graphite
Laitenberger, P. and Palmer, R.E.
page 79-84
- A new technique for studying surface reactions: the reaction of hydrogen with high pressure oxygen on palladium
Reisfeld, G. and Strongin, M.
page 85-89
- Optical characterization of electronic transitions arising from the Au/S interface of self-assembled n-alkanethiolate monolayers
J., S., B., H., Parikh, A.N., Collins, R.W. and Allara, D.L.
page 90-94
- Femtosecond relaxation of photoexcitations in a solution of a poly(para-phenylene)-type ladder polymer
Graupner, W., Leising, G., Lanzani, G., Nisoli, M., De Silvestri, S. and Scherf, U.
page 95-100
- Resonance Raman study on phase transition and molecular orientation in black soap films
Zhiqiang, Z., Yingqiu, L. and Yunhong, Z.
page 101-106
- Nanoscale visualization of microcrystalline chlorophyll a investigated with scanning tunneling microscopy
Boussaad, S., DeRose, J.A. and Leblanc, R.M.
page 107-113
- A perturbative correction to restricted open shell configuration interaction with single substitutions for excited states of radicals
Head-Gordon, M., Maurice, D. and Oumi, M.
page 114-121
- Pairwise solute descreening of solute charges from a dielectric medium
Hawkins, G.D., Cramer, C.J. and Truhlar, D.G.
page 122-129
- Evidence for enhanced intersystem crossing on pyrene fluorescence quenching with stable free radicals
Suzuki, T. and Obi, K.
page 130-134
- The luminescence of Pb2+ in alkaline earth sulfates
Folkerts, H.F., Hamstra, M.A. and Blasse, G.
page 135-138
- Photo-stationary state of UV pumped matrix isolated O2
Danilychev, A.V. and Apkarian, V.A.
page 139-144
- The C-X transition in CaKr+ and CaAr+
Buthelezi, T., Bellert, D., Lewis, V. and Brucat, P.J.
page 145-149
- The nature of the transitory product in the gas-phase ozonolysis of ethene
Neeb, P., Horie, O. and Moortgat, G.K.
page 150-156
- 104-fold isotope effect: vibrational predissociation in ArDF
Davis, S., Farrell, J.T. Jr., Anderson, D.T. and Nesbitt, D.J.
page 157-162
- Optical evidence for Rh(II) in a NaCl lattice
Gorller-Walrand, C., Gilliams, B. and D'Olieslager, J.
page 163-166
- An ESR study on the thermal electron excitation of a sodium atom incorporated in a silicon clathrate compound
Yahiro, H., Yamaji, K., Shiotani, M., Yamanaka, S. and Ishikawa, M.
page 167-170
- Effect of a high magnetic field on the decay rate of chain-linked intramolecular exciplex fluorescence
Cao, H., Miyata, K., Tamura, T., Fujiwara, Y., Tanimoto, Y., Okazaki, M., Iwai, K. and Yamamoto, M.
page 171-175
- Resonant Raman scattering in single crystals of BDNT, BDNT1+ and BDNT2+
Denisov, V.N., Ivlev, A.N., Mavrin, B.N., Yakushi, K., Dong, J. and Yamashita, Y.
page 176-182
- Vertical ionization potentials and CTTS energies for anions in water and acetonitrile
Takahashi, N., Sakai, K., Tanida, H. and Watanabe, I.
page 183-186
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