- Email: [email protected]
Subject index to volume 120
474
SUBJECT
INDEX
TO VOLUME
120
METHODS Theoretical
Classical mechanics Quasiclassical trajectory method for tunneling rates in the unimolecular of H:, J.M. Gomez Llorente and E. Pollak
decomposition
Many body and quasiparticle approaches H,S photoabsorption and photoionization cross sections by Stieltjes imaging, I. Cacelli, V. Carravetta and R. Moccia A simple method to calculate the correlation energy in molecules based on the bond orbital approximation, A.M. OleS, F. Pfirsch and M.C. Bohm The valence orbitals of NH, by electron momentum spectroscopy: quantitative comparisons using Hartree-Fock limit and correlated wavefunctions, A.O. Bawagan, R. Miiller-Fiedler, C.E. Brion, E.R. Davidson and C. Boyle Many-body perturbation theory and polarization propagator studies of the structure, energetics and excitation spectrum of CO,, S. Canuto and G.H.F. Diercksen
120 (1988)
37
120 (1988)
51
120 (1988)
65
120 (1988) 335 120 (1988) 375
Coupling schemes and perturbative treatments A trap potential model investigation of the optical activity induced in dye-DNA intercalation complexes, M. Kamiya Convergence of the Hartree-Fock Green matrix method, R.S. Chen, P. Otto, M. See1 and J. Ladik
120 (1988) 177
Statistical mechanics of stationary states Diffusion controlled reaction rate of molecules tion potential, A.I. Shushin
120 (1988)
with anisotropic
reactivity
Non-equilibrium thermodynamic and hydrodynamic theories Diffusion controlled reaction rate of molecules with anisotropic reactivity tion potential, A.I. Shushin Viscosity dependence of intramolecular activated processes, J. Schlitter
120 (1988)
79
and interac91
and interac-
Ab initio schemes for stationary properties Magnetic properties in terms of localized quantities. XI. Fluorine compounds of first-row elements, U. Fleischer and M. Schindler Ab initio studies on hydrogen-bonded clusters. II. Structures and vibrational spectra of the hydrogen-bonded trimers (HCN),HF, (HCN),HCl, (NCH),OH, and (NCH),NH,, S.-K. Rhee and A. Karpfen
120 (1988) 91 120 (1988) 187
120 (1988) 103
120 (1988) 199
475
Subject index
Molecular jet study and calculations of the vibronic structure of the aniline-benzene van der Waals complex, F. Lahmani, C. Lardeux-Dedonder, D. Solgadi and A. Zehnacker Many-body perturbation theory and polarization propagator studies of the structure, energetics and excitation spectrum of CO,, S. Canuto and G.H.F. Diercksen Electronic states of PN+ obtained by configuration-interaction studies, F. Grein Structural and spectral consequences of ion pairing. III. A theoretical study of J.S. Francisco and I.H. Williams NO, Li+ and NO;Na+, Reaction of amino radicals with olefins: theoretical aspects, D. Gonbeau, M.F. Guimon, J. Ollivier and G. Pfister-Guillouzo An MRD CI investigation of the photochemical isomerization of cyclohexadiene to hexatriene, P.E. Share, K.L. Kompa, S.D. Peyerimhoff and M.C. van Hemert Comparison of ab initio calculated and experimental methyl-top moments of inertia, J. Demaison, G. Wlodarczak, K. Siam, J.D. Ewbank and L. Schafer Computational and simulation methods Quasiclassical trajectory method for tunneling rates in the unimolecular decomposition of Hz, J.M. Gomez Llorente and E. Pollak H,S photoabsorption and photoionization cross sections by Stieltjes imaging, I. Cacelli, V. Carravetta and R. Moccia A simple method to calculate the correlation energy in molecules based on the bond orbital approximation, A.M. Oles, F. Pfirsch and M.C. Bohrn A trap potential model investigation of the optical activity induced in dye-DNA intercalation complexes, M. Kamiya Convergence of the Hartree-Fock Green matrix method, R.S. Chen, P. Otto, M. See1 and J. Ladik Collision-interrupted librational model for molecular reorientation in liquids, S.K. Deb Interaction potentials for the thallium ion-rare gas systems, CC. Kirkpatrick and L.A. Viehland Theoretical study of the stability of Agp, Agi, Ag,, Ag; and Na, clusters as a function of size using the density functional formalism, L.C. Balbas, A. Rubio, J.A. Alonso and G. Borstel Reaction of exciplex formation in the gas phase. The role of weak attractive interactions in the initial state, I. Deperasihska The fluorescence quenching rate constant for the distance-dependent quenching processes in the presence of diffusion, J. Najbar Molecular dynamics and scattering theory A trap potential model investigation of the optical activity intercalation complexes, M. Kamiya Models of nonadiabatic effects in the rotational structure of overtones, M.Ya. Ovchinnikova Semiclassical wave packet dynamics in nonadiabatic processes: between the % and A states of C,H:, D. Dehareng Kinematics and dynamical effects in the total and differential variational transition state theory analysis, M. Mentndez, L. A. Gonzalez Uretia Dynamic aspects of electronic excitation, M.V. Rama Krishna
induced
120 (1988) 215 120 (1988) 375 120 (1988) 383 120 (1988) 389 120 (1988) 399 120 (1988) 411 120 (1988) 421
120 (1988)
37
120 (1988)
51
120 (1988)
65
120 (1988)
79
120 (1988) 177 120 (1988) 225 120 (1988) 235
120 (1988) 239 120 (1988) 359 120 (1988) 367
in dye-DNA 120 (1988)
ammonia
N-H
79
stretch 120 (1988) 249
the conical
intersection 120 (198%) 261
excitation functions. A Baiiares, J, Alonso and and R.D. Coalson
120 (1988) 273 120 (1988) 327
416
Subject index
Experimental Magnetic resonances Separation and analysis of CIDNP spin orders for a coupled multiproton system, R. Hany, J.-K. Vollenweider and H. Fischer Magnetization transfer in pulsed EPR of i5N nitroxides: reorientational motion mode1 of molecules in glassy liquids, S.A. Dzuba and Yu.D. Tsvetkov Phosphorescent states of aromatic thioketones with large zero-field splittings investigated by optically detected magnetic resonance spectroscopy, M.J. Petrin, S. Ghosh and A.H. Maki EPR of layered magnetic metal-amino acid salts. II. Cu(L-Met),, P.R. Levstein, CA. Steren, A.M. Gennaro and R. Calvo
120 (1988) 449
Microwave spectroscopy Comparison of ab initio calculated and experimental methyl-top moments Demaison, G. Wlodarczak, K. Siam, J.D. Ewbank and L. Schafer
120 (1988) 421
of inertia,
120 (1988) 169 120 (1988) 291
120 (1988) 299
J.
Raman spectroscopy Collision-interrupted librational model for molecular reorientation in liquids, S.K. Deb Dynamic aspects of electronic excitation, M.V. Rama Krishna and R.D. Coalson Visible and UV spectroscopy A trap potential mode1 investigation of the optical activity induced in dye-DNA intercalation complexes, M. Kamiya The Cu + F2 chemiluminescent reaction revisited. I. Spectroscopy of the CuF product, P. Baltayan, F. Hartmann, J.C. Pebay-Peyroula and N. Sadeghi Energy selection experiments: the total phosphorescence spectrum of 1,4-diazatriphenylene, G.W. Suter and U.P. Wild The S, + S,, fluorescence of pseudoazulenes in Shpolskii matrices, A. 01szowski, S.E. Bucher and U.P. Wild Phosphorescent states of aromatic thioketones with large zero-field splittings investigated by optically detected magnetic resonance spectroscopy, M.J. Petrin, S. Ghosh and A.H. Maki Excited state dipole moments and polarizabilities of centrosymmetric and dimeric molecules. I. Mode1 study of a bichromophoric molecule, W. Liptay, R. Wortmann, H. Schaffrin, 0. Burkhard, W. Reitinger and N. Detzer Excited state dipole moments and polarizabilities of centrosymmetric and dimeric molecules. II. Polyenes, polyynes and cumulenes, W. Liptay, R. Wortmann, R. Biihm and N. Detzer Fluorescence spectroscopy Energy selection experiments: the total phosphorescence spectrum of 1,4-diazatriphenylene, G.W. Suter and U.P. Wild The S, + S, fluorescence of pseudoazulenes in Shpolskii matrices, A. 01szowski, S.E. Bucher and U.P. Wild Kinematics and dynamical effects in the total and differential excitation functions. A variational transition state theory analysis, M. Menendez, L. Baiiares, J. Alonso and A. Gonzalez Urefia
120 (1988) 225 120 (1988) 327
120 (1988)
79
120 (1988) 123 120 (1988) 131 120 (1988) 139
120 (1988) 299
120 (1988) 429
120 (1988) 439
120 (1988) 131 120 (1988) 139
120 (1988) 273
Subject index
471
Photoelectron and Auger spectroscopy Photoelectron studies of molecular chlorine using synchrotron radiation, T. Reddish, A.A. Cafolla and J. Comer
120 (1988) 149
Electron impact spectroscopy The valence orbitals of NH, by electron momentum spectroscopy: quantitative comparisons using Hartree-Fock limit and correlated wavefunctions, A.O. Bawagan, R. Miiller-Fiedler, C.E. Brion, E.R. Davidson and C. Boyle
120 (1988) 335
Laser metho& Photofragmentation LIF spectroscopy of NOCl at dissociation wavelengths > 450 nm. Parent electronic spectrum and spin state and A-doublet populations of nascent NO and Cl fragments, A.E. Bruno, U. Bruhlmann and J.R. Huber Molecular jet study and calculations of the vibronic structure of the aniline-benzene van der Waals complex, F. Lahmani, C. Lardeux-Dedonder, D. Solgadi and A. Zehnacker Kinematics and dynamical effects in the total and differential excitation functions. A variational transition state theory analysis, M. Menendez, L. Banares, J. Alonso and A. Gonzalez Ureiia Kinetics and mechanisms of CH radical reactions with fluoromethanes and carbon tetrachloride, S. Zabarnick, J.W. Fleming and M.C. Lin The reaction of OH and OD with nitromethane and OD with perdeuteronitromethane, S. Zabarnick, J.W. Fleming and M.C. Lin Dynamic aspects of electronic excitation, M.V. Rama Krishna and R.D. Coalson Quenching of the translationally hot and thermalized NH(c ‘II) radicals by HN,, H. Umemoto, J. Kikuma, S. Tsunashima and S. Sato
120 (1988) 155
120 (1988) 215
120 (1988) 273 120 (1988) 311 120 (1988) 319 120 (1988) 327 120 (1988) 461
Picosecond spectroscopy Inertial effects in the theory of dielectric and Kerr effect relaxation of an assembly of non-interacting polar molecules in strong alternating fields, W.T. Coffey and S.G. McGoldrick
120 (1988)
1
Non-linear optical spectroscopy Inertial effects in the theory of dielectric and Kerr effect relaxation of an assembly of non-interacting polar molecules in strong alternating fields, W.T. Coffey and S.G. McGoldrick
120 (1988)
1
Synchrotron spectroscopies Photoelectron studies of molecular chlorine using synchrotron radiation, T. Reddish, A.A. Cafolla and J. Comer
120 (1988) 149
Coherent optical spectroscopy A trap potential model investigation of the optical activity induced in dye-DNA intercalation complexes, M. Kamiya
120 (1988)
Multiple resonance spectroscopy Phosphorescent states of aromatic thioketones with large zero-field splittings investigated by optically detected magnetic resonance spectroscopy, M.J. Petrin, S. Ghosh and A.H. Maki
120 (1988) 299
79.
478
Subject index
Atomic and molecular beam techniques Kinematics and dynamical effects in the total and differential excitation functions. A variational transition state theory analysis, M. Menendez, L. Baiiares, J. Alonso and A. Gonzalez Uretia Time-resolved experiments Kinematics and dynamical effects in the total and differential excitation functions. A variational transition state theory analysis, M. Menendez, L. Banares, J. Alonso and A. Gonzalez Urea% Magnetization transfer in pulsed EPR of 15N nitroxides: reorientational motion model of molecules in glassy liquids, S.A. Dzuba and Yu.D. Tsvetkov The fluorescence quenching rate constant for the distance-dependent quenching processes in the presence of diffusion, J. Najbar Quenching of the translationally hot and thermalized NH(c ‘II) radicals by HN,, H. Umemoto, J. Kikuma, S. Tsunashima and S. Sato Measurement of macroscopic variables Excited state dipole moments and polarizabilities of centrosymmetric and dimeric molecules. I. Model study of a bichromophoric molecule, W. Liptay, R. Wortmann, H. Schaffrin, 0. Burkhard, W. Reitinger and N. Detzer Excited state dipole moments and polarizabilities of centrosymmetric and dimeric molecules. II. Polyenes, polyynes and cumulenes, W. Liptay, R. Wortmann, R. Bijhm and N. Detzer
120 (1988) 273
120 (1988) 273 120 (1988) 291 120 (1988) 367 120 (1988) 461
120 (1988) 429
120 (1988) 439
OBJECTS Bulk systems Gases Photofragmentation LIF spectroscopy of NOCl at dissociation wavelengths > 450 nm. Parent electronic spectrum and spin state and A-doublet populations of nascent NO and Cl fragments, A.E. Bruno, U. Bruhlmann and J.R. Huber Interaction potentials for the thallium ion-rare gas systems, C.C. Kirkpatrick and L.A. Viehland Kinetics and mechanisms of CH radical reactions with fluoromethanes and carbon tetrachloride, S. Zabarnick, J.W. Fleming and M.C. Lin Reaction of exciplex formation in the gas phase. The role of weak attractive interactions in the initial state, I. Deperasihska Quenching of the translationally hot and thermalized NH(c ‘II) radicals by HN,, H. Umemoto, J. Kikuma, S. Tsunashima and S. Sato Liquid mixtures and solutions Separation and analysis of CIDNP spin orders for a coupled multiproton system, R. Hany, J.-K. Vollenweider and H. Fischer Viscosity dependence of intramolecular activated processes, J. Schlitter Excited state dipole moments and polarizabilities of centrosymmetric and dimeric molecules. I. Model study of a bichromophoric molecule, W. Liptay, R. Wortmann, H. Schaffrin, 0. Burkhard, W. Reitinger and N. Detzer
120 (1988) 155 120 (1988) 235 120 (1988) 311 120 (1988) 359 120 (1988) 461
120 (1988) 169 120 (1988) 187
120 (1988) 429
479
Subject index
Excited state dipole moments and polarizabilities of centrosymmetric and dimeric molecules. II. Polyenes, polyynes and cumulenes, W. Liptay, R. Wortmann, R. Bbhm and N. Detzer
120 (1988) 439
Crystals EPR of layered magnetic Steren, A.M. Gennaro
120 (1988) 449
metal-amino acid salts. II. Cu(L-Met),, and R. Calvo
P.R. Levstein,
C.A.
- mixed The S, + S, fluorescence of pseudoazulenes in Shpolskii matrices, A. Olszowski, S.E. Bucher and U.P. Wild Phosphorescent states of aromatic thioketones with large zero-field splittings investigated by optically detected magnetic resonance spectroscopy, M.J. Petrin, S. Ghosh and A.H. Maki Glasses Magnetization transfer in pulsed EPR of “N of molecules in glassy liquids, S.A. Dzuba
nitroxides: reorientational and Yu.D. Tsvetkov
Low-dimensional materials EPR of layered magnetic metal-amino acid salts. II. Cu(L-Met),, Steren, A.M. Gennaro and R. Calvo
motion
P.R. Levstein,
120 (1988) 299
model 120 (1988) 291
CA.
Dielectrics Inertial effects in the theory of dielectric and Kerr effect relaxation of an assembly of non-interacting polar molecules in strong alternating fields, W.T. Coffey and S.G. McGoldrick Microscopic
120 (1988) 139
120 (1988) 449
120 (1988)
1
120 (1988)
51
120 (1988)
65
systems
Molecules (neutral and ionic) H,S photoabsorption and photoionization cross sections by Stieltjes imaging, I. Cacelli, V. Carravetta and R. Moccia A simple method to calculate the correlation energy in molecules based on the bond orbital approximation, A.M. OleS, F. Pfirsch and M.C. Bohm Excited state dipole moments and polarizabilities of centrosymmetric and dimeric molecules. II. Polyenes, polyynes and cumulenes, W. Liptay, R. Wortmann, R. Bijhm and N. Detzer - diatomic The Cu + F2 chemiluminescent reaction revisited. I. Spectroscopy of the CuF product, P. Baltayan, F. Hartmann, J.C. Pebay-Peyroula and N. Sadeghi Photoelectron studies of molecular chlorine using synchrotron radiation, T. Reddish, A.A. Cafolla and J. Comer Interaction potentials for the thallium ion-rare gas systems, CC. Kirkpatrick and L.A. Viehland Electronic states of PN+ obtained by configuration-interaction studies, F. Grein Quenching of the translationally hot and thermalized NH(c ‘II) radicals by HN,, H. Umemoto, J. Kikuma, S. Tsunashima and S. Sato
120 (1988) 439
120 (1988) 123 120 (1988) 149 120 (1988) 235 120 (1988) 383 120 (1988) 461
Subject index
480
-small polyatomics Quasiclassical trajectory method for tunneling rates in the unimolecular decomposition of H:, J.M. Gomez Llorente and E. Pollak Magnetic properties in terms of localized quantities. XI. Fluorine compounds of first-row elements, U. Fleischer and M. Schindler Photofragmentation LIF spectroscopy of NOCl at dissociation wavelengths > 450 nm. Parent electronic spectrum and spin state and A-doublet populations of nascent NO and Cl fragments, A.E. Bruno, U. Bruhlmann and J.R. Huber Models of nonadiabatic effects in the rotational structure of ammonia N-H stretch overtones, M.Ya. Ovchinnikova Semiclassical wave packet dynamics in nonadiabatic processes: the conical intersection between the X and A states of &Hi, D. Dehareng The valence orbitals of NH, by electron momentum spectroscopy: quantitative comparisons using Hartree-Fock limit and correlated wavefunctions, A.O. Bawagan, R. Mtiller-Fiedler, C.E. Brion, E.R. Davidson and C. Boyle Many-body perturbation theory and polarization propagator studies of the structure, energetics and excitation spectrum of CO,, S. Canuto and G.H.F. Diercksen Structural and spectral consequences of ion pairing. III. A theoretical study of NO, Li+ and NO; Na+, J.S. Francisco and I.H. Williams Comparison of ab initio calculated and experimental methyl-top moments of inertia, J. Demaison, G. Wlodarczak, K. Siam, J.D. Ewbank and L. Schafer
120 (1988)
37
120 (1988) 103
120 (1988) 155 120 (1988) 249 120 (1988) 261
120 (1988) 335 120 (1988) 375 120 (1988) 389 120 (1988) 421
- aromatics Energy selection experiments: the total phosphorescence spectrum of 1,4-diazatriphenylene, G.W. Suter and U.P. Wild The S, -+ S,, fluorescence of pseudoazulenes in Shpolskii matrices, A. Olszowski, S.E. Bucher and U.P. Wild Phosphorescent states of aromatic thioketones with large zero-field splittings investigated by optically detected magnetic resonance spectroscopy, M.J. Pet&, S. Ghosh and A.H. Maki
120 (1988) 299
- polymeric and biological Convergence of the Hartree-Fock Green matrix and J. Ladik Viscosity dependence of intramolecular activated
120 (1988) 177 120 (1988) 187
Molecular aggregates Reaction of exciplex tions in the initial
formation in the gas phase. state, I. Deperasihska
method, processes,
120 (1988) 131 120 (1988) 139
R.S. Chen, P. Otto, M. See1 J. Schlitter
The role of weak attractive
interac-
- dimers Molecular jet study and calculations of the vibronic structure of the aniline-benzene van der Waals complex, F. Lahmani, C. Lardeux-Dedonder, D. Solgadi and A. Zehnacker Excited state dipole moments and polarizabilities of centrosymmetric and dimeric molecules. I. Model study of a bichromophoric molecule, W. Liptay, R. Wortmann, H. Schaffrin, 0. Burkhard, W. Reitinger and N. Detzer
120 (1988) 359
120 (1988) 215
120 (1988) 429
481
Subject index
-van der Waals molecules Molecular jet study and calculations of the vibronic structure of the aniline-benzene van der Waals complex, F. Lahmani, C. Lardeux-Dedonder, D. Solgadi and A. Zehnacker - clusters Ab initio studies on hydrogen-bonded clusters. II. Structures and vibrational spectra of the hydrogen-bonded trimers (HCN) 2HF, (HCN) 2HCl, (NCH) ,OH 2 and (NCH),NH,, S.-K. Rhee and A. Karpfen Theoretical study of the stability of Agp:, Agi, Ag,, Ag; and Na& clusters as a function of size using the density functional formalism, L.C. Balbas, A. Rubio, J.A. Alonso and G. Borstel Free radicals (including hydronium and muon&m) Separation and analysis of CIDNP spin orders for a coupled multiproton system, R. Hany, J.-K. Vollenweider and H. Fischer Magnetization transfer in pulsed EPR of “N nitroxides: reorientational motion model of molecules in glassy liquids, S.A. Dzuba and Yu.D. Tsvetkov Kinetics and mechanisms of CH radical reactions with fluoromethanes and carbon tetrachloride, S. Zabamick, J.W. Fleming and M.C. Lin The reaction of OH and OD with nitromethane and OD with perdeuteronitromethane, S. Zabamick, J.W. Fleming and M.C. Lin Reaction of amino radicals with olefins: theoretical aspects, D. Gonbeau, M.F. Guimon, J. Ollivier and G. Pfister-Guillouzo Ions and charge carriers Interaction potentials for the thallium Viehland
ion-rare
gas systems,
C.C. Kirkpatrick
120 (1988) 215
120 (1988) 199
120 (1988) 239
120 (1988) 169 120 (1988) 291 120 (1988) 311 120 (1988) 319 120 (1988) 399
and L.A. 120 (1988) 235
PHENOMENA Molecular structure Ab initio studies on hydrogen-bonded clusters. II. Structures and vibrational spectra of the hydrogen-bonded trimers (HCN),HF, (HCN),HCl, (NCH),OH, and (NCH),NH,, S.-K. Rhee and A. Karpfen Many-body perturbation theory and polarization propagator studies of the structure, energetics and excitation spectrum of CO,, S. Canuto and G.H.F. Diercksen Structural and spectral consequences of ion pairing. III. A theoretical study of NO;Li+ and NO;Na+, J.S. Francisco and I.H. Williams Comparison of ab initio calculated and experimental methyl-top moments of inertia, J. Demaison, G. Wlodarczak, K. Siam, J.D. Ewbank and L. Schafer Vibrations and rotations of molecules The Cu + F2 chemiluminescent reaction revisited. I. Spectroscopy of the CuF product, P. Baltayan, F. Hartmann, J.C. Pebay-Peyroula and N. Sadeghi Photoelectron studies of molecular chlorine using synchrotron radiation, T. Reddish, A.A. Cafolla and J. Comer Ab initio studies on hydrogen-bonded clusters. II. Structures and vibrational spectra of the hydrogen-bonded trimers (HCN),HF, (HCN),HCl, (NCH)20H, and (NCH),NH,, S.-K. Rhee,and A. Karpfen
120 (1988) 199 120 (1988) 375 120 (1988) 389 120 (1988) 421
120 (1988) 123 120 (1988) 149
120 (1988) 199
482
Subject index
Models of nonadiabatic effects in the rotational structure of ammonia N-H stretch overtones, M.Ya. Ovchinnikova Dynamic aspects of electronic excitation, M.V. Rama Krishna and R.D. Coalson Structural and spectral consequences of ion pairing. III. A theoretical study of J.S. Francisco and I.H. Williams NO;Li+ and NO;Na+, Comparison of ab initio calculated and experimental methyl-top moments of inertia, J. Demaison, G. Wlodarczak, K. Siam, J.D. Ewbank and L. Schafer Electronic structure and states H,S photoabsorption and photoionization cross sections by Stieltjes imaging, I. Cacelli, V. Carravetta and R. Moccia A simple method to calculate the correlation energy in molecules based on the bond orbital approximation, A.M. OleS, F. Pfirsch and M.C. Bijhm The Cu + F2 chemiluminescent reaction revisited. I. Spectroscopy of the CuF product, P. Baltayan, F. Hartmann, J.C. Pebay-Peyroula and N. Sadeghi Convergence of the Hartree-Fock Green matrix method, R.S. Chen, P. Otto, M. See1 and J. Ladik Theoretical study of the stability of Agr, Agi, Ag,, Agh, and Na; clusters as a function of size using the density functional formalism, L.C. Balbas, A. Rubio, J.A. Alonso and G. Borstel The valence orbitals of NH, by electron momentum spectroscopy: quantitative comparisons using Hartree-Fock limit and correlated wavefunctions, A.O. Bawagan, R. Miiller-Fiedler, C.E. Brion, E.R. Davidson and C. Boyle Many-body perturbation theory and polarization propagator studies of the structure, energetics and excitation spectrum of CO,, S. Canuto and G.H.F. Diercksen Electronic states of PN+ obtained by configuration-interaction studies, F. Grein An MRD CI investigation of the photochemical isomerization of cyclohexadiene to hexatriene, P.E. Share, K.L. Kompa, S.D. Peyerimhoff and M.C. van Hemert Excited state dipole moments and polarizabilities of centrosymmetric and dimeric molecules. I. Model study of a bichromophoric molecule, W. Liptay, R. Wortmann, H. Schaffrin, 0. Burkhard, W. Reitinger and N. Detzer Excited state dipole moments and polarizabilities of centrosymmetric and dimeric molecules. II. Polyenes, polyynes and cumulenes, W. Liptay, R. Wortmann, R. Bohm and N. Detzer
120 (1988) 249 120 (1988) 327 120 (1988) 389 120 (1988) 421
120 (1988)
51
120 (1988)
65
120 (1988) 123 120 (1988) 177
120 (1988) 239
120 (1988) 335 120 (1988) 375 120 (1988) 383 120 (1988) 411
120 (1988) 429
120 (1988) 439
Electric and magnetic properties Magnetic properties in terms of localized quantities. XI. Fluorine compounds of first-row elements, U. Fleischer and M. Schindler EPR of layered magnetic metal-amino acid salts. II. Cu(L-Met),, P.R. Levstein, C.A. Steren, A.M. Gennaro and R. Calvo
120 (1988) 103
Molecular interactions Ab initio studies on hydrogen-bonded clusters. II. Structures and vibrational spectra of the hydrogen-bonded trimers (HCN), HF, (HCN) 2HCl, (NCH) ,OH z and (NCH),NH,, S.-K. Rhee and A. Karpfen Molecular jet study and calculations of the vibronic structure of the aniline-benzene van der Waals complex, F. Lahmani, C. Lardeux-Dedonder, D. Solgadi and A. Zehnacker
120 (1988) 199
120 (1988) 449
120 (1988) 215
483
Subject index
Dynamic aspects of electronic excitation, M.V. Rama Krishna and R.D. Coalson Reaction of amino radicals with olefins: theoretical aspects, D. Gonbeau, M.F. Guimon, J. Ollivier and G. Pfister-Guillouzo Spectral bandshapes and intensities Inertial effects in the theory of dielectric and Kerr effect relaxation of an assembly of non-interacting polar molecules in strong alternating fields, W.T. Coffey and S.G. McGoldrick Molecular photophysical processes H,S photoabsorption and photoionization cross sections by Stieltjes imaging, I. Cacelli, V. Carravetta and R. Moccia Energy selection experiments: the total phosphorescence spectrum of 1,4-diazatriphenylene, G.W. Suter and U.P. Wild The S, -+ S, fluorescence of pseudoazulenes in Shpolskii matrices, A. Olszowski, SE. Bucher and U.P. Wild An MRD CI investigation of the photochemical isomerization of cyclohexadiene to hexatriene, P.E. Share, K.L. Kompa, S.D. Peyerimhoff and M.C. van Hemert Intramolecular dynamics Quasiclassical trajectory method for tunneling rates in the unimolecular decomposition of H:, J.M. Gomez Llorente and E. Pollak Photofragmentation LIF spectroscopy of NOCl at dissociation wavelengths > 450 nm. Parent electronic spectrum and spin state and A-doublet populations of nascent NO and Cl fragments, A.E. Bruno, U. Bruhlmann and J.R. Huber Viscosity dependence of intramolecular activated processes, J. Schlitter -radiationless transitions Semiclassical wave packet dynamics in nonadiabatic processes: the conical intersection between the 2 and A states of C,H:, D. Dehareng An MRD CI investigation of the photochemical isomerization of cyclohexadiene to hexatriene, P.E. Share, K.L. Kompa, S.D. Peyerimhoff and M.C. van Hemert Luminescence spectra, yields and lifetimes Energy selection experiments: the total phosphorescence spectrum of 1,4-diazatriphenylene, G.W. Suter and U.P. Wild The S, + S, fluorescence of pseudoazulenes in Shpolskii matrices, A. Olszowski, S.E. Bucher and U.P. Wild The fluorescence quenching rate constant for the distance-dependent quenching processes in the presence of diffusion, J. Najbar
120 (1988) 327 120 (1988) 399
120 (1988)
1
120 (1988)
51
120 (1988) 131 120 (1988) 139 120 (1988) 411
120 (1988)
37
120 (1988) 155 120 (1988) 187
120 (1988) 261 120 (1988) 411
120 (1988) 131 120 (1988) 139 120 (1988) 367
Non-linear responses (including optical) Inertial effects in the theory of dielectric and Kerr effect relaxation of an assembly of non-interacting polar molecules in strong alternating fields, W.T. Coffey and S.G. McGoldrick
120 (1988)
Reactions (including dissociation) Kinetics and mechanisms of CH radical reactions with fluoromethanes tetrachloride, S. Zabarnick, J.W. Fleming and M.C. Lin
120 (1988) 311
1
and carbon
484
Subject index
The reaction of OH and OD with nitromethane S. Zabamick, J.W. Fleming and M.C. Lin
and OD with perdeuteronitromethane, 120 (1988) 319
-gas phase Quasiclassical trajectory method for tunneling rates in the unimolecular decomposition of Hl, J.M. Gbmez Llorente and E. Pollak Kinetics and mechanisms of CH radical reactions with fluoromethanes and carbon tetrachloride, S. Zabarnick, J.W. Fleming and M.C. Lin The reaction of OH and OD with nitromethane and OD with perdeuteronitromethane, S. Zabarnick, J.W. Fleming and M.C. Lin Reaction of exciplex formation in the gas phase. The role of weak attractive interactions in the initial state, I. Deperasinska Quenching of the translationally hot and thermalized NH(c ‘II) radicals by HN,, H. Umemoto, J. Kikuma, S. Tsunashima and S. Sato
120 (1988) 461
- condensed phase Separation and analysis of CIDNP spin orders Hany, J.-K. Vollenweider and H. Fischer
120 (1988) 169
for a coupled
multiproton
system,
Electron transfer Reaction of exciplex formation in the gas phase. The role of weak attractive interactions in the initial state, I. Deperasinska The fluorescence quenching rate constant for the distance-dependent quenching processes in the presence of diffusion, J. Najbar
using synchrotron
radiation,
37
120 (1988) 311 120 (1988) 319 120 (1988) 359
R.
- photochemical Separation and analysis of CIDNP spin orders for a coupled multiproton system, R. Hany, J.-K. Vollenweider and H. Fischer Reaction of amino radicals with olefins: theoretical aspects, D. Gonbeau, M.F. Guimon, J. Ollivier and G. Pfister-Guillouzo An MRD CI investigation of the photochemical isomerization of cyclohexadiene to hexatriene, P.E. Share, K.L. Kompa, S.D. Peyerimhoff and M.C. van Hemert
Ionization (including Rydberg states) Photoelectron studies of molecular chlorine A.A. Cafolla and J. Comer
120 (1988)
120 (1988) 169 120 (1988) 399 120 (1988) 411
120 (1988) 359 120 (1988) 367
T. Reddish, 120 (1988) 149
Molecular motion (including diffusive) Inertial effects in the theory of dielectric and Kerr effect relaxation of an assembly of non-interacting polar molecules in strong alternating fields, W.T. Coffey and S.G. McGoldrick Magnetization transfer in pulsed EPR of 15N nitroxides: reorientational motion model of molecules in glassy liquids, S.A. Dzuba and Yu.D. Tsvetkov The fluorescence quenching rate constant for the distance-dependent quenching processes in the presence of diffusion, J. Najbar
120 (1988) 367
Isotopic effects The reaction of OH and OD with nitromethane S. Zabarnick, J.W. Fleming and M.C. Lin
120 (1988) 319
Thermodynamic and transport properties Interaction potentials for the thallium ion-rare Viehland
120 (1988)
1
120 (1988) 291
and OD with perdeuteronitromethane,
gas systems,
CC. Kirkpatrick
and L.A. 120 (1988) 235
SUBJECT
INDEX
TO VOLUME
120
METHODS Theoretical
Classical mechanics Quasiclassical trajectory method for tunneling rates in the unimolecular of H:, J.M. Gomez Llorente and E. Pollak
decomposition
Many body and quasiparticle approaches H,S photoabsorption and photoionization cross sections by Stieltjes imaging, I. Cacelli, V. Carravetta and R. Moccia A simple method to calculate the correlation energy in molecules based on the bond orbital approximation, A.M. OleS, F. Pfirsch and M.C. Bohm The valence orbitals of NH, by electron momentum spectroscopy: quantitative comparisons using Hartree-Fock limit and correlated wavefunctions, A.O. Bawagan, R. Miiller-Fiedler, C.E. Brion, E.R. Davidson and C. Boyle Many-body perturbation theory and polarization propagator studies of the structure, energetics and excitation spectrum of CO,, S. Canuto and G.H.F. Diercksen
120 (1988)
37
120 (1988)
51
120 (1988)
65
120 (1988) 335 120 (1988) 375
Coupling schemes and perturbative treatments A trap potential model investigation of the optical activity induced in dye-DNA intercalation complexes, M. Kamiya Convergence of the Hartree-Fock Green matrix method, R.S. Chen, P. Otto, M. See1 and J. Ladik
120 (1988) 177
Statistical mechanics of stationary states Diffusion controlled reaction rate of molecules tion potential, A.I. Shushin
120 (1988)
with anisotropic
reactivity
Non-equilibrium thermodynamic and hydrodynamic theories Diffusion controlled reaction rate of molecules with anisotropic reactivity tion potential, A.I. Shushin Viscosity dependence of intramolecular activated processes, J. Schlitter
120 (1988)
79
and interac91
and interac-
Ab initio schemes for stationary properties Magnetic properties in terms of localized quantities. XI. Fluorine compounds of first-row elements, U. Fleischer and M. Schindler Ab initio studies on hydrogen-bonded clusters. II. Structures and vibrational spectra of the hydrogen-bonded trimers (HCN),HF, (HCN),HCl, (NCH),OH, and (NCH),NH,, S.-K. Rhee and A. Karpfen
120 (1988) 91 120 (1988) 187
120 (1988) 103
120 (1988) 199
475
Subject index
Molecular jet study and calculations of the vibronic structure of the aniline-benzene van der Waals complex, F. Lahmani, C. Lardeux-Dedonder, D. Solgadi and A. Zehnacker Many-body perturbation theory and polarization propagator studies of the structure, energetics and excitation spectrum of CO,, S. Canuto and G.H.F. Diercksen Electronic states of PN+ obtained by configuration-interaction studies, F. Grein Structural and spectral consequences of ion pairing. III. A theoretical study of J.S. Francisco and I.H. Williams NO, Li+ and NO;Na+, Reaction of amino radicals with olefins: theoretical aspects, D. Gonbeau, M.F. Guimon, J. Ollivier and G. Pfister-Guillouzo An MRD CI investigation of the photochemical isomerization of cyclohexadiene to hexatriene, P.E. Share, K.L. Kompa, S.D. Peyerimhoff and M.C. van Hemert Comparison of ab initio calculated and experimental methyl-top moments of inertia, J. Demaison, G. Wlodarczak, K. Siam, J.D. Ewbank and L. Schafer Computational and simulation methods Quasiclassical trajectory method for tunneling rates in the unimolecular decomposition of Hz, J.M. Gomez Llorente and E. Pollak H,S photoabsorption and photoionization cross sections by Stieltjes imaging, I. Cacelli, V. Carravetta and R. Moccia A simple method to calculate the correlation energy in molecules based on the bond orbital approximation, A.M. Oles, F. Pfirsch and M.C. Bohrn A trap potential model investigation of the optical activity induced in dye-DNA intercalation complexes, M. Kamiya Convergence of the Hartree-Fock Green matrix method, R.S. Chen, P. Otto, M. See1 and J. Ladik Collision-interrupted librational model for molecular reorientation in liquids, S.K. Deb Interaction potentials for the thallium ion-rare gas systems, CC. Kirkpatrick and L.A. Viehland Theoretical study of the stability of Agp, Agi, Ag,, Ag; and Na, clusters as a function of size using the density functional formalism, L.C. Balbas, A. Rubio, J.A. Alonso and G. Borstel Reaction of exciplex formation in the gas phase. The role of weak attractive interactions in the initial state, I. Deperasihska The fluorescence quenching rate constant for the distance-dependent quenching processes in the presence of diffusion, J. Najbar Molecular dynamics and scattering theory A trap potential model investigation of the optical activity intercalation complexes, M. Kamiya Models of nonadiabatic effects in the rotational structure of overtones, M.Ya. Ovchinnikova Semiclassical wave packet dynamics in nonadiabatic processes: between the % and A states of C,H:, D. Dehareng Kinematics and dynamical effects in the total and differential variational transition state theory analysis, M. Mentndez, L. A. Gonzalez Uretia Dynamic aspects of electronic excitation, M.V. Rama Krishna
induced
120 (1988) 215 120 (1988) 375 120 (1988) 383 120 (1988) 389 120 (1988) 399 120 (1988) 411 120 (1988) 421
120 (1988)
37
120 (1988)
51
120 (1988)
65
120 (1988)
79
120 (1988) 177 120 (1988) 225 120 (1988) 235
120 (1988) 239 120 (1988) 359 120 (1988) 367
in dye-DNA 120 (1988)
ammonia
N-H
79
stretch 120 (1988) 249
the conical
intersection 120 (198%) 261
excitation functions. A Baiiares, J, Alonso and and R.D. Coalson
120 (1988) 273 120 (1988) 327
416
Subject index
Experimental Magnetic resonances Separation and analysis of CIDNP spin orders for a coupled multiproton system, R. Hany, J.-K. Vollenweider and H. Fischer Magnetization transfer in pulsed EPR of i5N nitroxides: reorientational motion mode1 of molecules in glassy liquids, S.A. Dzuba and Yu.D. Tsvetkov Phosphorescent states of aromatic thioketones with large zero-field splittings investigated by optically detected magnetic resonance spectroscopy, M.J. Petrin, S. Ghosh and A.H. Maki EPR of layered magnetic metal-amino acid salts. II. Cu(L-Met),, P.R. Levstein, CA. Steren, A.M. Gennaro and R. Calvo
120 (1988) 449
Microwave spectroscopy Comparison of ab initio calculated and experimental methyl-top moments Demaison, G. Wlodarczak, K. Siam, J.D. Ewbank and L. Schafer
120 (1988) 421
of inertia,
120 (1988) 169 120 (1988) 291
120 (1988) 299
J.
Raman spectroscopy Collision-interrupted librational model for molecular reorientation in liquids, S.K. Deb Dynamic aspects of electronic excitation, M.V. Rama Krishna and R.D. Coalson Visible and UV spectroscopy A trap potential mode1 investigation of the optical activity induced in dye-DNA intercalation complexes, M. Kamiya The Cu + F2 chemiluminescent reaction revisited. I. Spectroscopy of the CuF product, P. Baltayan, F. Hartmann, J.C. Pebay-Peyroula and N. Sadeghi Energy selection experiments: the total phosphorescence spectrum of 1,4-diazatriphenylene, G.W. Suter and U.P. Wild The S, + S,, fluorescence of pseudoazulenes in Shpolskii matrices, A. 01szowski, S.E. Bucher and U.P. Wild Phosphorescent states of aromatic thioketones with large zero-field splittings investigated by optically detected magnetic resonance spectroscopy, M.J. Petrin, S. Ghosh and A.H. Maki Excited state dipole moments and polarizabilities of centrosymmetric and dimeric molecules. I. Mode1 study of a bichromophoric molecule, W. Liptay, R. Wortmann, H. Schaffrin, 0. Burkhard, W. Reitinger and N. Detzer Excited state dipole moments and polarizabilities of centrosymmetric and dimeric molecules. II. Polyenes, polyynes and cumulenes, W. Liptay, R. Wortmann, R. Biihm and N. Detzer Fluorescence spectroscopy Energy selection experiments: the total phosphorescence spectrum of 1,4-diazatriphenylene, G.W. Suter and U.P. Wild The S, + S, fluorescence of pseudoazulenes in Shpolskii matrices, A. 01szowski, S.E. Bucher and U.P. Wild Kinematics and dynamical effects in the total and differential excitation functions. A variational transition state theory analysis, M. Menendez, L. Baiiares, J. Alonso and A. Gonzalez Urefia
120 (1988) 225 120 (1988) 327
120 (1988)
79
120 (1988) 123 120 (1988) 131 120 (1988) 139
120 (1988) 299
120 (1988) 429
120 (1988) 439
120 (1988) 131 120 (1988) 139
120 (1988) 273
Subject index
471
Photoelectron and Auger spectroscopy Photoelectron studies of molecular chlorine using synchrotron radiation, T. Reddish, A.A. Cafolla and J. Comer
120 (1988) 149
Electron impact spectroscopy The valence orbitals of NH, by electron momentum spectroscopy: quantitative comparisons using Hartree-Fock limit and correlated wavefunctions, A.O. Bawagan, R. Miiller-Fiedler, C.E. Brion, E.R. Davidson and C. Boyle
120 (1988) 335
Laser metho& Photofragmentation LIF spectroscopy of NOCl at dissociation wavelengths > 450 nm. Parent electronic spectrum and spin state and A-doublet populations of nascent NO and Cl fragments, A.E. Bruno, U. Bruhlmann and J.R. Huber Molecular jet study and calculations of the vibronic structure of the aniline-benzene van der Waals complex, F. Lahmani, C. Lardeux-Dedonder, D. Solgadi and A. Zehnacker Kinematics and dynamical effects in the total and differential excitation functions. A variational transition state theory analysis, M. Menendez, L. Banares, J. Alonso and A. Gonzalez Ureiia Kinetics and mechanisms of CH radical reactions with fluoromethanes and carbon tetrachloride, S. Zabarnick, J.W. Fleming and M.C. Lin The reaction of OH and OD with nitromethane and OD with perdeuteronitromethane, S. Zabarnick, J.W. Fleming and M.C. Lin Dynamic aspects of electronic excitation, M.V. Rama Krishna and R.D. Coalson Quenching of the translationally hot and thermalized NH(c ‘II) radicals by HN,, H. Umemoto, J. Kikuma, S. Tsunashima and S. Sato
120 (1988) 155
120 (1988) 215
120 (1988) 273 120 (1988) 311 120 (1988) 319 120 (1988) 327 120 (1988) 461
Picosecond spectroscopy Inertial effects in the theory of dielectric and Kerr effect relaxation of an assembly of non-interacting polar molecules in strong alternating fields, W.T. Coffey and S.G. McGoldrick
120 (1988)
1
Non-linear optical spectroscopy Inertial effects in the theory of dielectric and Kerr effect relaxation of an assembly of non-interacting polar molecules in strong alternating fields, W.T. Coffey and S.G. McGoldrick
120 (1988)
1
Synchrotron spectroscopies Photoelectron studies of molecular chlorine using synchrotron radiation, T. Reddish, A.A. Cafolla and J. Comer
120 (1988) 149
Coherent optical spectroscopy A trap potential model investigation of the optical activity induced in dye-DNA intercalation complexes, M. Kamiya
120 (1988)
Multiple resonance spectroscopy Phosphorescent states of aromatic thioketones with large zero-field splittings investigated by optically detected magnetic resonance spectroscopy, M.J. Petrin, S. Ghosh and A.H. Maki
120 (1988) 299
79.
478
Subject index
Atomic and molecular beam techniques Kinematics and dynamical effects in the total and differential excitation functions. A variational transition state theory analysis, M. Menendez, L. Baiiares, J. Alonso and A. Gonzalez Uretia Time-resolved experiments Kinematics and dynamical effects in the total and differential excitation functions. A variational transition state theory analysis, M. Menendez, L. Banares, J. Alonso and A. Gonzalez Urea% Magnetization transfer in pulsed EPR of 15N nitroxides: reorientational motion model of molecules in glassy liquids, S.A. Dzuba and Yu.D. Tsvetkov The fluorescence quenching rate constant for the distance-dependent quenching processes in the presence of diffusion, J. Najbar Quenching of the translationally hot and thermalized NH(c ‘II) radicals by HN,, H. Umemoto, J. Kikuma, S. Tsunashima and S. Sato Measurement of macroscopic variables Excited state dipole moments and polarizabilities of centrosymmetric and dimeric molecules. I. Model study of a bichromophoric molecule, W. Liptay, R. Wortmann, H. Schaffrin, 0. Burkhard, W. Reitinger and N. Detzer Excited state dipole moments and polarizabilities of centrosymmetric and dimeric molecules. II. Polyenes, polyynes and cumulenes, W. Liptay, R. Wortmann, R. Bijhm and N. Detzer
120 (1988) 273
120 (1988) 273 120 (1988) 291 120 (1988) 367 120 (1988) 461
120 (1988) 429
120 (1988) 439
OBJECTS Bulk systems Gases Photofragmentation LIF spectroscopy of NOCl at dissociation wavelengths > 450 nm. Parent electronic spectrum and spin state and A-doublet populations of nascent NO and Cl fragments, A.E. Bruno, U. Bruhlmann and J.R. Huber Interaction potentials for the thallium ion-rare gas systems, C.C. Kirkpatrick and L.A. Viehland Kinetics and mechanisms of CH radical reactions with fluoromethanes and carbon tetrachloride, S. Zabarnick, J.W. Fleming and M.C. Lin Reaction of exciplex formation in the gas phase. The role of weak attractive interactions in the initial state, I. Deperasihska Quenching of the translationally hot and thermalized NH(c ‘II) radicals by HN,, H. Umemoto, J. Kikuma, S. Tsunashima and S. Sato Liquid mixtures and solutions Separation and analysis of CIDNP spin orders for a coupled multiproton system, R. Hany, J.-K. Vollenweider and H. Fischer Viscosity dependence of intramolecular activated processes, J. Schlitter Excited state dipole moments and polarizabilities of centrosymmetric and dimeric molecules. I. Model study of a bichromophoric molecule, W. Liptay, R. Wortmann, H. Schaffrin, 0. Burkhard, W. Reitinger and N. Detzer
120 (1988) 155 120 (1988) 235 120 (1988) 311 120 (1988) 359 120 (1988) 461
120 (1988) 169 120 (1988) 187
120 (1988) 429
479
Subject index
Excited state dipole moments and polarizabilities of centrosymmetric and dimeric molecules. II. Polyenes, polyynes and cumulenes, W. Liptay, R. Wortmann, R. Bbhm and N. Detzer
120 (1988) 439
Crystals EPR of layered magnetic Steren, A.M. Gennaro
120 (1988) 449
metal-amino acid salts. II. Cu(L-Met),, and R. Calvo
P.R. Levstein,
C.A.
- mixed The S, + S, fluorescence of pseudoazulenes in Shpolskii matrices, A. Olszowski, S.E. Bucher and U.P. Wild Phosphorescent states of aromatic thioketones with large zero-field splittings investigated by optically detected magnetic resonance spectroscopy, M.J. Petrin, S. Ghosh and A.H. Maki Glasses Magnetization transfer in pulsed EPR of “N of molecules in glassy liquids, S.A. Dzuba
nitroxides: reorientational and Yu.D. Tsvetkov
Low-dimensional materials EPR of layered magnetic metal-amino acid salts. II. Cu(L-Met),, Steren, A.M. Gennaro and R. Calvo
motion
P.R. Levstein,
120 (1988) 299
model 120 (1988) 291
CA.
Dielectrics Inertial effects in the theory of dielectric and Kerr effect relaxation of an assembly of non-interacting polar molecules in strong alternating fields, W.T. Coffey and S.G. McGoldrick Microscopic
120 (1988) 139
120 (1988) 449
120 (1988)
1
120 (1988)
51
120 (1988)
65
systems
Molecules (neutral and ionic) H,S photoabsorption and photoionization cross sections by Stieltjes imaging, I. Cacelli, V. Carravetta and R. Moccia A simple method to calculate the correlation energy in molecules based on the bond orbital approximation, A.M. OleS, F. Pfirsch and M.C. Bohm Excited state dipole moments and polarizabilities of centrosymmetric and dimeric molecules. II. Polyenes, polyynes and cumulenes, W. Liptay, R. Wortmann, R. Bijhm and N. Detzer - diatomic The Cu + F2 chemiluminescent reaction revisited. I. Spectroscopy of the CuF product, P. Baltayan, F. Hartmann, J.C. Pebay-Peyroula and N. Sadeghi Photoelectron studies of molecular chlorine using synchrotron radiation, T. Reddish, A.A. Cafolla and J. Comer Interaction potentials for the thallium ion-rare gas systems, CC. Kirkpatrick and L.A. Viehland Electronic states of PN+ obtained by configuration-interaction studies, F. Grein Quenching of the translationally hot and thermalized NH(c ‘II) radicals by HN,, H. Umemoto, J. Kikuma, S. Tsunashima and S. Sato
120 (1988) 439
120 (1988) 123 120 (1988) 149 120 (1988) 235 120 (1988) 383 120 (1988) 461
Subject index
480
-small polyatomics Quasiclassical trajectory method for tunneling rates in the unimolecular decomposition of H:, J.M. Gomez Llorente and E. Pollak Magnetic properties in terms of localized quantities. XI. Fluorine compounds of first-row elements, U. Fleischer and M. Schindler Photofragmentation LIF spectroscopy of NOCl at dissociation wavelengths > 450 nm. Parent electronic spectrum and spin state and A-doublet populations of nascent NO and Cl fragments, A.E. Bruno, U. Bruhlmann and J.R. Huber Models of nonadiabatic effects in the rotational structure of ammonia N-H stretch overtones, M.Ya. Ovchinnikova Semiclassical wave packet dynamics in nonadiabatic processes: the conical intersection between the X and A states of &Hi, D. Dehareng The valence orbitals of NH, by electron momentum spectroscopy: quantitative comparisons using Hartree-Fock limit and correlated wavefunctions, A.O. Bawagan, R. Mtiller-Fiedler, C.E. Brion, E.R. Davidson and C. Boyle Many-body perturbation theory and polarization propagator studies of the structure, energetics and excitation spectrum of CO,, S. Canuto and G.H.F. Diercksen Structural and spectral consequences of ion pairing. III. A theoretical study of NO, Li+ and NO; Na+, J.S. Francisco and I.H. Williams Comparison of ab initio calculated and experimental methyl-top moments of inertia, J. Demaison, G. Wlodarczak, K. Siam, J.D. Ewbank and L. Schafer
120 (1988)
37
120 (1988) 103
120 (1988) 155 120 (1988) 249 120 (1988) 261
120 (1988) 335 120 (1988) 375 120 (1988) 389 120 (1988) 421
- aromatics Energy selection experiments: the total phosphorescence spectrum of 1,4-diazatriphenylene, G.W. Suter and U.P. Wild The S, -+ S,, fluorescence of pseudoazulenes in Shpolskii matrices, A. Olszowski, S.E. Bucher and U.P. Wild Phosphorescent states of aromatic thioketones with large zero-field splittings investigated by optically detected magnetic resonance spectroscopy, M.J. Pet&, S. Ghosh and A.H. Maki
120 (1988) 299
- polymeric and biological Convergence of the Hartree-Fock Green matrix and J. Ladik Viscosity dependence of intramolecular activated
120 (1988) 177 120 (1988) 187
Molecular aggregates Reaction of exciplex tions in the initial
formation in the gas phase. state, I. Deperasihska
method, processes,
120 (1988) 131 120 (1988) 139
R.S. Chen, P. Otto, M. See1 J. Schlitter
The role of weak attractive
interac-
- dimers Molecular jet study and calculations of the vibronic structure of the aniline-benzene van der Waals complex, F. Lahmani, C. Lardeux-Dedonder, D. Solgadi and A. Zehnacker Excited state dipole moments and polarizabilities of centrosymmetric and dimeric molecules. I. Model study of a bichromophoric molecule, W. Liptay, R. Wortmann, H. Schaffrin, 0. Burkhard, W. Reitinger and N. Detzer
120 (1988) 359
120 (1988) 215
120 (1988) 429
481
Subject index
-van der Waals molecules Molecular jet study and calculations of the vibronic structure of the aniline-benzene van der Waals complex, F. Lahmani, C. Lardeux-Dedonder, D. Solgadi and A. Zehnacker - clusters Ab initio studies on hydrogen-bonded clusters. II. Structures and vibrational spectra of the hydrogen-bonded trimers (HCN) 2HF, (HCN) 2HCl, (NCH) ,OH 2 and (NCH),NH,, S.-K. Rhee and A. Karpfen Theoretical study of the stability of Agp:, Agi, Ag,, Ag; and Na& clusters as a function of size using the density functional formalism, L.C. Balbas, A. Rubio, J.A. Alonso and G. Borstel Free radicals (including hydronium and muon&m) Separation and analysis of CIDNP spin orders for a coupled multiproton system, R. Hany, J.-K. Vollenweider and H. Fischer Magnetization transfer in pulsed EPR of “N nitroxides: reorientational motion model of molecules in glassy liquids, S.A. Dzuba and Yu.D. Tsvetkov Kinetics and mechanisms of CH radical reactions with fluoromethanes and carbon tetrachloride, S. Zabamick, J.W. Fleming and M.C. Lin The reaction of OH and OD with nitromethane and OD with perdeuteronitromethane, S. Zabamick, J.W. Fleming and M.C. Lin Reaction of amino radicals with olefins: theoretical aspects, D. Gonbeau, M.F. Guimon, J. Ollivier and G. Pfister-Guillouzo Ions and charge carriers Interaction potentials for the thallium Viehland
ion-rare
gas systems,
C.C. Kirkpatrick
120 (1988) 215
120 (1988) 199
120 (1988) 239
120 (1988) 169 120 (1988) 291 120 (1988) 311 120 (1988) 319 120 (1988) 399
and L.A. 120 (1988) 235
PHENOMENA Molecular structure Ab initio studies on hydrogen-bonded clusters. II. Structures and vibrational spectra of the hydrogen-bonded trimers (HCN),HF, (HCN),HCl, (NCH),OH, and (NCH),NH,, S.-K. Rhee and A. Karpfen Many-body perturbation theory and polarization propagator studies of the structure, energetics and excitation spectrum of CO,, S. Canuto and G.H.F. Diercksen Structural and spectral consequences of ion pairing. III. A theoretical study of NO;Li+ and NO;Na+, J.S. Francisco and I.H. Williams Comparison of ab initio calculated and experimental methyl-top moments of inertia, J. Demaison, G. Wlodarczak, K. Siam, J.D. Ewbank and L. Schafer Vibrations and rotations of molecules The Cu + F2 chemiluminescent reaction revisited. I. Spectroscopy of the CuF product, P. Baltayan, F. Hartmann, J.C. Pebay-Peyroula and N. Sadeghi Photoelectron studies of molecular chlorine using synchrotron radiation, T. Reddish, A.A. Cafolla and J. Comer Ab initio studies on hydrogen-bonded clusters. II. Structures and vibrational spectra of the hydrogen-bonded trimers (HCN),HF, (HCN),HCl, (NCH)20H, and (NCH),NH,, S.-K. Rhee,and A. Karpfen
120 (1988) 199 120 (1988) 375 120 (1988) 389 120 (1988) 421
120 (1988) 123 120 (1988) 149
120 (1988) 199
482
Subject index
Models of nonadiabatic effects in the rotational structure of ammonia N-H stretch overtones, M.Ya. Ovchinnikova Dynamic aspects of electronic excitation, M.V. Rama Krishna and R.D. Coalson Structural and spectral consequences of ion pairing. III. A theoretical study of J.S. Francisco and I.H. Williams NO;Li+ and NO;Na+, Comparison of ab initio calculated and experimental methyl-top moments of inertia, J. Demaison, G. Wlodarczak, K. Siam, J.D. Ewbank and L. Schafer Electronic structure and states H,S photoabsorption and photoionization cross sections by Stieltjes imaging, I. Cacelli, V. Carravetta and R. Moccia A simple method to calculate the correlation energy in molecules based on the bond orbital approximation, A.M. OleS, F. Pfirsch and M.C. Bijhm The Cu + F2 chemiluminescent reaction revisited. I. Spectroscopy of the CuF product, P. Baltayan, F. Hartmann, J.C. Pebay-Peyroula and N. Sadeghi Convergence of the Hartree-Fock Green matrix method, R.S. Chen, P. Otto, M. See1 and J. Ladik Theoretical study of the stability of Agr, Agi, Ag,, Agh, and Na; clusters as a function of size using the density functional formalism, L.C. Balbas, A. Rubio, J.A. Alonso and G. Borstel The valence orbitals of NH, by electron momentum spectroscopy: quantitative comparisons using Hartree-Fock limit and correlated wavefunctions, A.O. Bawagan, R. Miiller-Fiedler, C.E. Brion, E.R. Davidson and C. Boyle Many-body perturbation theory and polarization propagator studies of the structure, energetics and excitation spectrum of CO,, S. Canuto and G.H.F. Diercksen Electronic states of PN+ obtained by configuration-interaction studies, F. Grein An MRD CI investigation of the photochemical isomerization of cyclohexadiene to hexatriene, P.E. Share, K.L. Kompa, S.D. Peyerimhoff and M.C. van Hemert Excited state dipole moments and polarizabilities of centrosymmetric and dimeric molecules. I. Model study of a bichromophoric molecule, W. Liptay, R. Wortmann, H. Schaffrin, 0. Burkhard, W. Reitinger and N. Detzer Excited state dipole moments and polarizabilities of centrosymmetric and dimeric molecules. II. Polyenes, polyynes and cumulenes, W. Liptay, R. Wortmann, R. Bohm and N. Detzer
120 (1988) 249 120 (1988) 327 120 (1988) 389 120 (1988) 421
120 (1988)
51
120 (1988)
65
120 (1988) 123 120 (1988) 177
120 (1988) 239
120 (1988) 335 120 (1988) 375 120 (1988) 383 120 (1988) 411
120 (1988) 429
120 (1988) 439
Electric and magnetic properties Magnetic properties in terms of localized quantities. XI. Fluorine compounds of first-row elements, U. Fleischer and M. Schindler EPR of layered magnetic metal-amino acid salts. II. Cu(L-Met),, P.R. Levstein, C.A. Steren, A.M. Gennaro and R. Calvo
120 (1988) 103
Molecular interactions Ab initio studies on hydrogen-bonded clusters. II. Structures and vibrational spectra of the hydrogen-bonded trimers (HCN), HF, (HCN) 2HCl, (NCH) ,OH z and (NCH),NH,, S.-K. Rhee and A. Karpfen Molecular jet study and calculations of the vibronic structure of the aniline-benzene van der Waals complex, F. Lahmani, C. Lardeux-Dedonder, D. Solgadi and A. Zehnacker
120 (1988) 199
120 (1988) 449
120 (1988) 215
483
Subject index
Dynamic aspects of electronic excitation, M.V. Rama Krishna and R.D. Coalson Reaction of amino radicals with olefins: theoretical aspects, D. Gonbeau, M.F. Guimon, J. Ollivier and G. Pfister-Guillouzo Spectral bandshapes and intensities Inertial effects in the theory of dielectric and Kerr effect relaxation of an assembly of non-interacting polar molecules in strong alternating fields, W.T. Coffey and S.G. McGoldrick Molecular photophysical processes H,S photoabsorption and photoionization cross sections by Stieltjes imaging, I. Cacelli, V. Carravetta and R. Moccia Energy selection experiments: the total phosphorescence spectrum of 1,4-diazatriphenylene, G.W. Suter and U.P. Wild The S, -+ S, fluorescence of pseudoazulenes in Shpolskii matrices, A. Olszowski, SE. Bucher and U.P. Wild An MRD CI investigation of the photochemical isomerization of cyclohexadiene to hexatriene, P.E. Share, K.L. Kompa, S.D. Peyerimhoff and M.C. van Hemert Intramolecular dynamics Quasiclassical trajectory method for tunneling rates in the unimolecular decomposition of H:, J.M. Gomez Llorente and E. Pollak Photofragmentation LIF spectroscopy of NOCl at dissociation wavelengths > 450 nm. Parent electronic spectrum and spin state and A-doublet populations of nascent NO and Cl fragments, A.E. Bruno, U. Bruhlmann and J.R. Huber Viscosity dependence of intramolecular activated processes, J. Schlitter -radiationless transitions Semiclassical wave packet dynamics in nonadiabatic processes: the conical intersection between the 2 and A states of C,H:, D. Dehareng An MRD CI investigation of the photochemical isomerization of cyclohexadiene to hexatriene, P.E. Share, K.L. Kompa, S.D. Peyerimhoff and M.C. van Hemert Luminescence spectra, yields and lifetimes Energy selection experiments: the total phosphorescence spectrum of 1,4-diazatriphenylene, G.W. Suter and U.P. Wild The S, + S, fluorescence of pseudoazulenes in Shpolskii matrices, A. Olszowski, S.E. Bucher and U.P. Wild The fluorescence quenching rate constant for the distance-dependent quenching processes in the presence of diffusion, J. Najbar
120 (1988) 327 120 (1988) 399
120 (1988)
1
120 (1988)
51
120 (1988) 131 120 (1988) 139 120 (1988) 411
120 (1988)
37
120 (1988) 155 120 (1988) 187
120 (1988) 261 120 (1988) 411
120 (1988) 131 120 (1988) 139 120 (1988) 367
Non-linear responses (including optical) Inertial effects in the theory of dielectric and Kerr effect relaxation of an assembly of non-interacting polar molecules in strong alternating fields, W.T. Coffey and S.G. McGoldrick
120 (1988)
Reactions (including dissociation) Kinetics and mechanisms of CH radical reactions with fluoromethanes tetrachloride, S. Zabarnick, J.W. Fleming and M.C. Lin
120 (1988) 311
1
and carbon
484
Subject index
The reaction of OH and OD with nitromethane S. Zabamick, J.W. Fleming and M.C. Lin
and OD with perdeuteronitromethane, 120 (1988) 319
-gas phase Quasiclassical trajectory method for tunneling rates in the unimolecular decomposition of Hl, J.M. Gbmez Llorente and E. Pollak Kinetics and mechanisms of CH radical reactions with fluoromethanes and carbon tetrachloride, S. Zabarnick, J.W. Fleming and M.C. Lin The reaction of OH and OD with nitromethane and OD with perdeuteronitromethane, S. Zabarnick, J.W. Fleming and M.C. Lin Reaction of exciplex formation in the gas phase. The role of weak attractive interactions in the initial state, I. Deperasinska Quenching of the translationally hot and thermalized NH(c ‘II) radicals by HN,, H. Umemoto, J. Kikuma, S. Tsunashima and S. Sato
120 (1988) 461
- condensed phase Separation and analysis of CIDNP spin orders Hany, J.-K. Vollenweider and H. Fischer
120 (1988) 169
for a coupled
multiproton
system,
Electron transfer Reaction of exciplex formation in the gas phase. The role of weak attractive interactions in the initial state, I. Deperasinska The fluorescence quenching rate constant for the distance-dependent quenching processes in the presence of diffusion, J. Najbar
using synchrotron
radiation,
37
120 (1988) 311 120 (1988) 319 120 (1988) 359
R.
- photochemical Separation and analysis of CIDNP spin orders for a coupled multiproton system, R. Hany, J.-K. Vollenweider and H. Fischer Reaction of amino radicals with olefins: theoretical aspects, D. Gonbeau, M.F. Guimon, J. Ollivier and G. Pfister-Guillouzo An MRD CI investigation of the photochemical isomerization of cyclohexadiene to hexatriene, P.E. Share, K.L. Kompa, S.D. Peyerimhoff and M.C. van Hemert
Ionization (including Rydberg states) Photoelectron studies of molecular chlorine A.A. Cafolla and J. Comer
120 (1988)
120 (1988) 169 120 (1988) 399 120 (1988) 411
120 (1988) 359 120 (1988) 367
T. Reddish, 120 (1988) 149
Molecular motion (including diffusive) Inertial effects in the theory of dielectric and Kerr effect relaxation of an assembly of non-interacting polar molecules in strong alternating fields, W.T. Coffey and S.G. McGoldrick Magnetization transfer in pulsed EPR of 15N nitroxides: reorientational motion model of molecules in glassy liquids, S.A. Dzuba and Yu.D. Tsvetkov The fluorescence quenching rate constant for the distance-dependent quenching processes in the presence of diffusion, J. Najbar
120 (1988) 367
Isotopic effects The reaction of OH and OD with nitromethane S. Zabarnick, J.W. Fleming and M.C. Lin
120 (1988) 319
Thermodynamic and transport properties Interaction potentials for the thallium ion-rare Viehland
120 (1988)
1
120 (1988) 291
and OD with perdeuteronitromethane,
gas systems,
CC. Kirkpatrick
and L.A. 120 (1988) 235