13 June 1997 ELSEVIER Chemical Physics Letters 271 (1997) 387-393 Author index to volume 271 Abbott, B., see Shebaro, L. 271 (1997) 73 Aklint, T., see Persson, J.L. 271 (1997) 61 Aliev, R.R., see Kusumi, T. 271 (1997) 355 Alvira, E., J.A. Mayoral and J.1. Garcia, Molecular modelling study of B-cyclodextrin inclusion complexes 271 (1997) 178 Amemiya, T., see Kusumi, T. 271 (1997) 355 Andersson, M., see Persson, J.L. 271 (1997) 61 Andrews, P.M., see Pryor, B.A. 271 (1997) 19 Aquilanti, V., D. Cappelletti and F. Pirani, Bond stabilization by charge transfer: the transition from Van der Waals forces to the simplest chemical bonds 271 (1997) 216 Astrand, P.-O., K. Ruud, K.V. Mikkelsen and T. Helgaker, The magnetizability anisotropy and rotational g factor of deuterium hydride and the deuterium molecule 271 (1997) 163 Balasubramanian, K., see Dai, D. 271 (1997) 118 Ballone, P., see Rovira, C. 271 (1997) 247 Baran, E.J., see Brondino, C.D. 271 (1997) 51 Baranovi¢, G., Generalized harmonic mode scrambling 271 (1997) 226 Beck, C., see Grebenshchikov, S.Yu. 271 (1997) 197 Belli, S.. G. Buffa and O. Tarrini, On the extension of the Rydberg—Ritz principle to the collisional relaxation of molecular and atomic lines 271 (1997) 349 Berberan-Santos, M.N., see Salazar, F.A. 271 (1997) 361 Berger, M.B., see Pryor, B.A. 271 (1997) 19 Billing, G.D., see Kroes, G.-J. 271 (1997) 311 Birklund-Andersen, K., E. Vogel and J. Waluk, Electronic transition moment directions and tautomerization of 9,10,19,20-tetra-n-propylporphycene 271 (1997) 341 Bonzel, H.P., G. Pirug and J. Verhasselt, Low temperature growth of SiO, films on Si(100) using a hot molecular beam of tetraethoxysilane 271 (1997) 113 Borgis, D., see Staib, A. 271 (1997) 232 Broer, R., see de Graaf, C. 271 (1997) 372 Brondino, C.D., R. Calvo and E.J. Baran, EPR measurements in copper saccharinate single crystals 271 (1997) SI Brunold, T.C., H.U. Giidel and A.A. Kaminskii, Optical spectroscopy of V** doped crystals of Mg,SiO, and Ca,GeO, 271 (1997) 327 Buffa, G., see Belli, S. 271 (1997) 349 Calvo, R., see Brondino, C.D. 271 (1997) 51 Cappelletti, D., see Aquilanti, V. 271 (1997) 216 Carter, E.A., see Gibson, D.A. 271 (1997) 266 388 Author index to volume 271 Castro, M., C. Jamorski and D.R. Salahub, Structure, bonding, and magnetism of small Fe,, Co, and Ni, clusters, n <5 271 (19971)3 3 Chandra, Asit.K., see Sumathi, R. 271 (19972)8 7 Chane-Ching, K., see Fiorini, C. 271 (19973)3 5 Chang, B.H., see No, K.T. 271 (19971)5 2 Charra, F., see Fiorini, C. 271 (19973)3 5 Chemla, D.S., see Ha, T. 271 (1997) 1 Christiansen, O., see Halkier, A. 271 (19972)7 3 Clary, D.C., see Krause, P.J. 271 (19971)7 1 Dai, D. and K. Balasubramanian, Electronic states of Pb,: geometries and energy separa- tions 271 (1997) 118 De Graaf, C., R. Broer and W.C. Nieuwpoort, Comparison of the superexchange interac- tion in NiO and in a NiO[100] surface 271 (1997) 372 Deng, L., W.R. Garrett and M.G. Payne, Pressure dependence of the ac Stark shifts in nitric oxide: resonant multiphoton spectroscopy without space charge 271 (1997) 15 Emerson, A.P.J., S. Faetti and C. Zannoni, Monte Carlo simulation of the nematic—vapour interface for a Gay—Berne liquid crystal 271 (1997) 241 Enderle, Th., see Ha, T. 271 (1997) 1 Ernsting, N.P., see Kovalenko, S.A. 271 (1997) 40 Faetti, S., see Emerson, A.P.J. 271 (1997) 241 Fedorov, A., see Salazar, F.A. 271 (1997) 361 Fiedler, A. and S. Iwata, Portrait of diatomic FeN. A theoretical study 271 (1997) 143 Fiorini, C., J.-M. Nunzi, F. Charra, F. Kajzar, M. Lequan, R.-M. Lequan and K. Chane-Ching, Light-induced orientation of a low absorbing phosphine oxide azo- dye /PMMA copolymer: towards a trade-off between transparency and photoinduced non-linearity 271 (1997) 335 Fléthmann, H., see Grebenshchikov, S.Yu. 271 (1997) 197 Frank, O. and J.-M. Rost, Diffraction effects in the photoionization of clusters 271 (1997) 367 Friedrich, B., see Shebaro, L. 271 (1997) 73 Galle, J., see Richartz, Th. 271 (1997) 79 Garcia, J.I., see Alvira, E. 271 (19971)7 8 Garrett, W.R., see Deng, L. 271 (1997) 15 Gibson, D.A. and E.A. Carter, Ab initio molecular dynamics of pseudorotating Li, 271 (19972)6 6 Gleghorn, J.T., A G1 study of the isomers of CIOOBr and related systems 271 (19972)9 6 Goldman, S., see Gray, C.G. 271 (19971)8 5 Goren, §.D., see Panich, A.M. 271 (19973)8 1 Graf, U., see Niikura, H. 271 (19973)8 5 Gray, C.G., S. Goldman, B. Tomberli and W. Li, Comment on **Correlation lengths and density fluctuations in supercritical states of carbon dioxide”’ 271 (1997) 185 Grebenshchikov, S.Yu., C. Beck, H. Fléthmann, D.H. Mordaunt and R. Schinke, Revivals in triatomic molecules: influence of mode mixing 271 (1997) 197 Gu, R.A., see Huang, Q.J. 271 (1997) 101 Giidel, H.U., see Brunold, T.C. 271 (1997) 327 Author index to volume 271 Ha, T., Th. Enderle, D.S. Chemla, P.R. Selvin and S. Weiss, Quantum jumps of single molecules at room temperature 271 (1997) 1 Halkier, A., O. Christiansen, D. Sundholm and P. Pyykké, An improved value of the nuclear quadrupole moment of the 197 keV I = $ excited state of ‘°F 271 (1997) 273 Hamaguchi, H., see Tokumura, K. 271 (1997) 320 Hamilton, W.D., see Mattar, S.M. 271 (1997) 125 Han, K.-L., see Zhang, H. 271 (1997) 204 Hashimoto, H., see Kusumi, T. 271 (1997) 355 Hashimoto, M., see Tokumura, K. 271 (1997) 320 Hayashi, S., see Ueda, T. 271 (1997) 55 He, G.-Z., see Zhang, H. 271 (1997) 204 Helgaker, T., see Astrand, P.-O. 271 (1997) 163 Herschbach, D., see Shebaro, L. 271 (1997) 73 Hiraoka, K., J. Katsuragawa, T. Sugiyama, A. Minamitsu, S$. Yamabe and H. Kouno, Thermochemistry and structure of the cluster ions CH}(CO), and SiH}(CO), in the gas phase 271 (1997) 302 Hirayama, S., see Niikura, H. 271 (1997) 385 Holmgren, L., see Persson, J.L. 271 (1997) 61 Hong, T., see Shebaro, L. 271 (1997) 73 Huang, Q.J., J.L. Yao, B.W. Mao, R.A. Gu and Z.Q. Tian, Surface Raman spectroscopic studies of pyrazine adsorbed onto nickel electrodes 271 (1997) 101 Hwang, J.-K. and A. Warshel, On the relationship between the dispersed polaron and spin-boson models 271 (1997) 223 Ichida, M., M. Sakai, T. Yajima, A. Nakamura and H. Shinohara, Luminescence due to intra- and inter-molecular transition in C,) single crystals 271 (1997) 27 Itoh, M., see Tokumura, K. 271 (1997) 320 Iwata, S., see Fiedler, A. 271 (1997) 143 Jamorski, C., see Castro, M. 271 (1997) 133 Jhon, M.S., see No, K.T. 271 (1997) 152 Kajzar, F., see Fiorini, C. 271 (1997) 335 Kambanis, K.G., see Lazarou, Y.G. 271 (1997) 280 Kaminskii, A.A., see Brunold, T.C. 271 (1997) 327 Katsuragawa, J., see Hiraoka, K. 271 (1997) 302 Kim, S.Y., see No, K.T. 271 (1997) 152 Kingston, C.T., see Mattar, S.M. 271 (1997) 125 Klose, G., see Richartz, Th. 271 (1997) 79 Kérés, E., see Kurin-Csérgei, K. 271 (1997) 67 Kouno, H., see Hiraoka, K. 271 (1997) 302 Kovalenko, S.A., J. Ruthmann and N.P. Ernsting, Ultrafast Stokes shift and excited-state transient absorption of coumarin 153 in solution 271 (1997) 40 Krause, PJ. and D.C. Clary, The vibrational predissociation of HeBr,: a wavepacket study 271 (1997) 171 Kroes, G.-J., M.C. van Hemert, G.D. Billing and D. Neuhauser, Photodissociation of CH,(1°B,) through the coupled 2 A’ and 3A’ states: quantitative branching ratios for the prodouf CcH +t Hi anod Cn + H, 271 (1997) 311 390 Author index to volume 27] Kurin-Csérgei, K., G. Nagy and E. K6rés, Temperature-triggered chemical oscillators. A peculiar temperature effect in perturbed uncatalyzed bromate-driven reactions 271 (1997) 67 Kusumi, T., T. Yamaguchi, R.R. Aliev, T. Amemiya, T. Ohmori, H. Hashimoto and K. Yoshikawa, Numerical study on time delay for chemical wave transmission via an inactive gap 271 (1997) 355 Lahmani, F. and A. Zehnacker-Rentien, Spectroscopic study of jet-cooled heterodimers of salicylic acid with acetic and trifluoroacetic acids 271 (1997) 6 Lazarou, Y.G., K.G. Kambanis and P. Papagiannakopoulos, Ab initio computational study of the interaction of Cl atoms with HI, CH! and CH,OCH,1 271 (19972)8 0 Lee, D.J., see Liu, C.1. 271 (19971)6 7 Lee, Y.R., see Longfellow, C.A. 271 (1997) 33 Lee, Y.T., see Longfellow, C.A. 271 (1997) 33 Lequan, M., see Fiorini, C. 271 (19973)3 5 Lequan, R.-M., see Fiorini, C. 271 (19973)3 5 Le Rille, A., A. Tadjeddine, W.Q. Zheng and A. Peremans, Vibrational spectroscopy of a Au(hki)-electrolyte interface by in situ visible—infrared difference frequency generation 271 (1997) 95 Li, H., A. Lund, M. Lindgren, E. Sagstuen and H. Yahiro, Motional dynamics of NO, on Na-ZSM-5: an ESR investigation 271 (1997) 84 Li, H.L., see Zhang, J. 271 (1997) 90 Li, W., see Gray, C.G. 271 (1997) 185 Lin, S.M., see Longfellow, C.A. 271 (1997) 33 Lindgren, M., see Li, H. 271 (1997) 84 Liu, C.1., HJ. Wen and D.J. Lee, Bifurcation sequences in an incompletely macromixed Stirred tank 271 (1997) 167 Liu, Z.F., see Zhang, J. 271 (1997) 90 Longfellow, C.A., L.A. Smoliar, Y.T. Lee, Y.R. Lee, C.Y. Yeh and S.M. Lin, The photodissociation dynamics of hexafluoropropene examined at 193 nm 271 (1997) 33 Lou, N.-Q., see Zhang, H. 271 (1997) 204 Lund, A., see Li, H. 271 (1997) 84 Manassen, Y., see Shachal, D. 271 (1997) 107 Mao, B.W., see Huang, Q.J. 271 (1997) 101 Mattar, S.M., W.D. Hamilton and C.T. Kingston, Accuracy of the MRSD-CI technique in computing the X *£* ScO and TiN hyperfine tensors 271 (1997) 125 Mayoral, J.A., see Alvira, E. 271 (1997) 178 Mikkelsen, K.V., see Astrand, P.-O. 271 (1997) 163 Minamitsu, A., see Hiraoka, K. 271 (1997) 302 Mordaunt, D.H., see Grebenshchikov, S.Yu. 271 (1997) 197 Munakata, T., T. Sakashita, M. Tsukakoshi and J. Nakamura, Fine structure of the two-photon photoemission from benzene adsorbed on Cu(1 11) 271 (1997) 377 Nagy, G., see Kurin-Csérgei, K. 271 (1997) 67 Nakagawa, T., see Tokumura, K. 271 (19973)2 0 Nakajima, T., see Panich, A.M. 271 (19973)8 1 Nakamura, A., see Ichida, M. 271 (1997) 27 Nakamura, J., see Munakata, T. 271 (19973)7 7 Natsume, M., see Tokumura, K. 271 (19973)2 0 Author index to volume 271 1 Neuhauser, D., see Kroes, G.-J. 271 (1997) 311 Nieuwpoort, W.C., see de Graaf, C. 271 (1997) 372 Niikura, H., U. Graf and S. Hirayama, Intramolecular non-radiative relaxation from the first excited singlet background manifolds of anthracene and 9,10-dichloroanthracene in partially jet-cooled states (Chem. Phys. Letters 266 (1997) 217). Erratum 271 (1997) 385 Nishikawa, K., Reply to Comment on ‘‘Correlation lengths and density fluctuations in supercritical states of carbon dioxide’ 271 (1997) 188 No, K.T., B.H. Chang, S.Y. Kim, M.S. Jhon and H.A. Scheraga, Description of the potential energy surface of the water dimer with an artificial neural network 271 (1997) 152 Nunzi, J.-M., see Fiorini, C. 271 (1997) 335 Ohmori, T., see Kusumi, T. 271 (1997) 355 Palmer, P.M., see Pryor, B.A. 271 (1997) 19 Panich, A.M., T. Nakajima and S.D. Goren, '"F NMR study of C-F bonding and localization effects in fluorine-intercalated graphite 271 (1997) 381 Papagiannakopoulos, P., see Lazarou, Y.G. 271 (1997) 280 Parrinello, M., see Rovira, C. 271 (1997) 247 Payne, M.G., see Deng, L. 271 (1997) 15 Peremans, A., see Le Rille, A. 271 (1997) 95 Persson, J.L., M. Andersson, L. Holmgren, T. Aklint and A. Rosén, Ionization potentials of oxidized copper clusters 271 (1997) 61 Pirani, F., see Aquilanti, V. 271 (1997) 216 Pirug, G., see Bonzel, H.P. 271 (1997) 113 Pryor, B.A., P.M. Palmer, P.M. Andrews, M.B. Berger, T. Troxler and M.R. Topp, Spectroscopy of jet-cooled polar complexes of aminophthalimides 271 (1997) 19 Pyykk6, P., see Halkier, A. 271 (1997) 273 Richartz, Th., J. Galle and G. Klose, Water interaction with oligo-(ethoxy ethylene glycols 271 (1997) 79 Rosén, A., see Persson, J.L. 271 (1997) 61 Rost, J.-M., see Frank, O. 271 (1997) 367 Rovira, C., P. Ballone and M. Parrinello, A density functional study of iron-porphyrin complexes 271 (1997) 247 Ruthmann, J., see Kovalenko, S.A. 271 (1997) 40 Ruud, K., see Astrand, P.-O. 271 (1997) 163 Sagstuen, E., see Li, H. 271 (1997) 84 Sakai, M., see Ichida, M. 271 (1997) 27 Sakashita, T., see Munakata, T. 271 (1997) 377 Salahub, D.R., see Castro, M. 271 (1997) 133 Salazar, F.A., A. Fedorov and M.N. Berberan-Santos, A study of thermally activated delayed fluorescence in C,,, 271 (1997) 361 Scheraga, H.A., see No, K.T. 271 (1997) 152 Schinke, R., see Grebenshchikov, S.Yu. 271 (1997) 197 Selvin, P.R., see Ha, T. 271 (1997) 1 Shachal, D. and Y. Manassen, Through bond tunneling in an immobilized alkane chain on Si(111)7 X 7 studied by STM 271 (1997) 107 Shebaro, L., B. Abbott, T. Hong, A. Slenczka, B. Friedrich and D. Herschbach, Facile production of higher hydrocarbons from ethane in a catalytic supersonic nozzle 271 (1997) 73 392 Author index to volume 271 Shinohara, H., see Ichida, M. 271 (1997) 27 Skokov, S. and R.A. Wheeler, Study of hydrogen abstraction reactions by density-func- tional methods 271 (1997) 251 Slenczka, A., see Shebaro, L. 271 (1997) 73 Smedarchina, Z. and F. Zerbetto, An Instanton approach to hindered torsions: methyl glycolate — a case study 271 (1997) 189 Smoliar, L.A., see Longfellow, C.A. 271 (1997) 33 Staib, A. and D. Borgis, A quantum multi-mode molecular dynamics approach to the vibrational spectroscopy of solvated hydrogen-bonded complexes 271 (1997) 232 Stolte, S., see Vrakking, M.J.J. 271 (1997) 209 Sugiyama, T., see Hiraoka, K. 271 (1997) 302 Sumathi, R. and Asit.K. Chandra, Quantum chemical study of hydrogen-bonded CH, =C=0...HX and CH, =C=CH, ... HX (X = Cl, F) complexes 271 (1997) 287 Sundholm, D., see Halkier, A. 271 (1997) 273 Tadjeddine, A., see Le Rille, A. 271 (1997) 95 Tarrini, O., see Belli, S. 271 (1997) 349 Tian, Z.Q., see Huang, Q.J. 271 (1997) 101 Tokumura, K., M. Natsume, T. Nakagawa, M. Hashimoto, T. Yuzawa, H. Hamaguchi and M. Itoh, Time-resolved infrared study of ground-state phototautomer formed in the excited-state proton transfer of 7-hydroxyquinoline in methanol 271 (1997) 320 Tomberli, B., see Gray, C.G. 271 (1997) 185 Topp, M.R., see Pryor, B.A. 271 (1997) 19 Troxler, T., see Pryor, B.A. 271 (1997) 19 Tsukakoshi, M., see Munakata, T. 271 (1997) 377 Ueda, T. and S. Hayashi, 'H NMR study of the spin dynamics in layered perovskite paramagnets [R-NH ,],CuCl, (R = C,H, p-nitro-C,H,, C,H,CH,CH,) 271 (1997) 55 Van Hemert, M.C., see Kroes, G.-J. 271 (1997) 311 Verhasselt, J., see Bonzel, H.P. 271 (1997) 113 Vogel, E., see Birklund-Andersen, K. 271 (1997) 341 Vrakking, M.J.J. and S. Stolte, Coherent control of molecular orientation 271 (19972)0 9 Waluk, J., see Birklund-Andersen, K. 271 (1997) 341 Wang, Y.A., Padé approximants in density functional theory (Chem. Phys. Letters 268 (1997) 76). Erratum 271 (1997) 386 Warshel, A., see Hwang, J.-K. 271 (1997) 223 Weiss, S., see Ha, T. 271 (1997) 1 Wen, H.J., see Liu, C.I. 271 (1997) 167 Wheeler, R.A., see Skokov, S. 271 (1997) 251 Xian, H., see Yan, G. 271 (1997) 157 Xie, D., see Yan, G. 271 (1997) 157 Yahiro, H., see Li, H. 271 (1997) 84 Yajima, T., see Ichida, M. 271 (1997) 27 Yamabe, S., see Hiraoka, K. 271 (1997) 302 Yamaguchi, T., see Kusumi, T. 271 (1997) 355 Author index to volume 271 Yan, G., H. Xian and D. Xie, A potential energy surface for the electronic ground state of N,O 271 (1997) 157 Yao, J.L., see Huang, QJ. 271 (1997) 101 Yeh, C.Y., see Longfellow, C.A. 271 (1997) 33 Yoshikawa, K., see Kusumi, T. 271 (1997) 355 Yu, C., see Yu, J.-S.K. 271 (1997) 259 Yu, J.-S.K. and C. Yu, Ab initio study of the decomposition of formaldehyde 271 (1997) 259 Yuzawa, T., see Tokumura, K. 271 (1997) 320 Zannoni, C., see Emerson, A.P.J. 271 (1997) 241 Zehnacker-Rentien, A., see Lahmani, F. 271 (1997) 6 Zerbetto, F., see Smedarchina, Z. 271 (1997) 189 Zhang, H., K.-L. Han, Y. Zhao, G.-Z. He and N.-Q. Lou, A real time dynamical calculation of H, photodissociation 271 (1997) 204 Zhang, H.L., see Zhang, J. 271 (1997) 90 Zhang, J., J. Zhao, H.L. Zhang, H.L. Li and Z.F. Liu, Structural evaluation of azobenzene- functionalized self-assembled monolayers on gold by reflectance FTIR spectroscopy 271 (1997) 90 Zhao, J., see Zhang, J. 271 (1997) 90 Zhao, Y., see Zhang, H. 271 (1997) 204 Zheng, W.Q., see Le Rille, A. 271 (1997) 95