Chemical Physics Letters.
1997, V 280, N 3-4, Dec 5.
ISSN 0009-2614
CONSEQUENCES FOR FINITE ELECTRONIC SYSTEMS OF HOMOGENEITY PROPERTIES OF
DENSITY-FUNCTIONAL ENERGY COMPONENTS.
Parr RG; Liu SB. p 159-166
SECOND-ORDER MULTICONFIGURATIONAL DIRAC-FOCK SELF-CONSISTENT FIELD AND
MULTIREFERENCE CONFIGURATION INTERACTION CALCULATIONS ON BERYLLIUM AND
BERYLLIUM-LIKE NE6+.
Vilkas MJ; Koc K; Ishikawa Y. p 167-176
VIBRATIONALLY RESOLVED SPECTRA FROM SHORT-TIME QUANTUM MOLECULAR DYNAMICS
BY THE FILTER-DIAGONALIZATION METHOD.
Jungwirth P; Schmidt B; Moiseyev N. p 177-184
APPLICATION OF TRAJECTORY SURFACE HOPPING TO VIBRATIONAL PREDISSOCIATION.
Bastida A; Zuniga J; Requena A; Sola I; Halberstadt N; Beswick JA.
p 185-188
THE APPLICATION OF A GENETIC ALGORITHM FOR SOLVING CRYSTAL STRUCTURES FROM
POWDER DIFFRACTION DATA.
Kariuki BM; Serranogonzalez H; Johnston RL; Harris KDM. p 189-195
ON THE HYDROGEN BONDING ABILITIES OF PHENOLS AND ANISOLES.
Nobeli I; Yeoh SL; Price SL; Taylor R. p 196-202
DYNAMIC POLARIZABILITY AND HYPERPOLARIZABILITY FOR THE 14 ELECTRON
MOLECULES CO AND BF.
Merawa M; Begue D; Rerat M; Pouchan C. p 203-211
ELECTRONIC STATES OF TA2C+.
Majumdar D; Balasubramanian K. p 212-218
ELECTRONIC STATES AND POTENTIAL ENERGY CURVES OF IRIDIUM CARBIDE (IRC).
Tan H; Liao MZ; Balasubramanian K. p 219-226
AN MO STUDY OF NEUTRAL C-8 HIGH-SYMMETRY CLUSTERS.
Nyronen TH; Suontamo R. p 227-232
AB INITIO STUDY OF INTRAMOLECULAR PROTON TRANSFER REACTIONS IN CYTOSINE.
Morpurgo S; Bossa M; Morpurgo GO. p 233-238
AN AB INITIO STUDY OF GEOMETRIES, POLARIZABILITIES, AND ROTATION BARRIERS
OF POLYPHENYLSILANE OLIGOMERS.
Ortiz JV; Rohlfing CM. p 239-243
AN AB INITIO STUDY CONCERNING THE EXPERIMENTAL OBSERVABILITY OF C3H62+
ISOMERS.
Mayer PM; Radom L. p 244-250
PHOTOIONIZATION AND DISSOCIATION OF BF3-CENTER-DOT((CH3)(2)O)(N) MIXED
AGGREGATES (N = 1, 2) STUDIED BY MASS SPECTROMETRY AND AB INITIO
CALCULATIONS.
Ring S; Eisenhardt CG; Baumgartel H. p 251-259
RELATIVE STABILITIES OF ORTHO-, META- AND PARA-TOLYL CATIONS.
Shin SK. p 260-265
COMPLEXATION OF SMALL ORGANIC MOLECULES BY CU+.
Hoyau S; Ohanessian G. p 266-272
COMPUTATIONAL STUDY OF THE (CH3ZN)(2)B3H7 AND CH3ZNBH4 DIMERS.
Mckee ML. p 273-279
HYBRID QUANTUM AND CLASSICAL MECHANICAL MONTE CARLO SIMULATIONS OF THE
INTERACTION OF HYDROGEN CHLORIDE WITH SOLID WATER CLUSTERS.
Estrin DA; Kohanoff J; Laria DH; Weht RO. p 280-286
THE APPEARANCE OF ATHERMAL NUCLEI OF THYMINE AT AU(111) AND THE SHAPE OF
CURRENT-TIME TRANSIENTS.
Donner C; Kirste S; Pohlmann L; Baumgartel H. p 287-295
IMAGING OF INDIVIDUAL FORMATE IONS ADSORBED ON TIO2(110) SURFACE BY
NON-CONTACT ATOMIC FORCE MICROSCOPY.
Fukui K; Onishi H; Iwasawa Y. p 296-301
THE SURFACE CHEMISTRY OF 1,3-CYCLOHEXADIENE AND 1,4-CYCLOHEXADIENE ON
PT(111) STUDIED BY SURFACE VIBRATIONAL SPECTROSCOPY WITH SUM FREQUENCY
GENERATION.
Su XC; Shen YR; Somorjai GA. p 302-307
PHOTOPHYSICAL INVESTIGATION ON MOLECULAR AGGREGATION OF
1-BENZYL-2-HYDRO[60]FULLERENE IN LANGMUIR-BLODGETT MULTILAYERS.
Ma SH; Lu XZ; Xu JH; Zhou GP; Cai ZG; Zhou JY; Wang WC; Li YF. p 308-314
QUENCHING OF PYRENE FLUORESCENCE BY FULLERENE C-60 IN LANGMUIR-BLODGETT
FILMS.
Sluch MI; Samuel IDW; Petty MC. p 315-320
VACUUM ULTRAVIOLET EXCITED LUMINESCENCE OF AG+ IMPURITIES IN KMGF3.
Scacco A; Finocchi M; Mattei C; Grassano UM; Francini R; Zema N.
p 321-324
ANOMALOUS TEMPERATURE DEPENDENCE OF THE IR SPECTRUM OF POLYALANINE.
Helenius V; Korppitommola J; Kotila S; Nieminen J; Lohikoski R; Timonen J.
p 325-332
SPECTROSCOPIC PROPERTIES OF GD3+-DOPED FLUOROZIRCONATE GLASS.
Binnemans K; Gorllerwalrand C; Adam JL. p 333-338
FEMTOSECOND TIME-RESOLVED FOUR-WAVE MIXING SPECTROSCOPY IN IODINE VAPOUR.
Schmitt M; Knopp G; Materny A; Kiefer W. p 339-347
PHOTOABSORPTION AND PHOTOFRAGMENTATION STUDIES OF ACETYLOXY IODIDE ANION
CH3CO2I-.
Saeki M; Zhu L; Tsukuda T; Iwata S; Nagata T. p 348-352
KINETIC ISOTOPE EFFECT IN HYDROGEN ABSTRACTION FROM 2-PROPANOL BY HYDROGEN
AND DEUTERIUM RADICALS - A PULSE RADIOLYSIS FOURIER TRANSFORM ELECTRON
SPIN RESONANCE STUDY.
Geimer J; Beckert D; Jenichen A. p 353-358
THE VIBRATIONAL DEACTIVATION OF N-2(V = 1) BY H-2 AND HD AT LOW
TEMPERATURES.
Reid JP; Barnes PW; Simpson CJSM. p 359-366
THE INFLUENCE OF THE ATTRACTIVE WELL ON NEAR-RESONANT VIBRATIONAL ENERGY
TRANSFER IN THE GAS PHASE - THE IMPORTANCE OF THIRD BODY COLLISIONS.
Reid JP; Simpson CJSM. p 367-374
HIGH-PRESSURE STUDIES OF SECOND HARMONIC GENERATION IN ORGANIC MATERIALS.
Yang G; Li Y; Dreger ZA; White JO; Drickamer HG. p 375-380
STUDY ON IRON-SULFUR CLUSTER IN GAS PHASE - ELECTRONIC STRUCTURE AND
REACTIVITY.
Nakajima A; Hayase T; Hayakawa F; Kaya K. p 381-389
STRUCTURE AND HYDROGEN-BONDING INTERACTIONS IN JET-COOLED
TROPOLONE-ACETONE.
Hamabe H; Sekiya H; Nakano N; Nishi K; Nishimura Y. p 390-396
STRUCTURAL AND ELECTRON TRANSFER PROPERTIES OF CYTOCHROME C ADSORBED ON
GRAPHITE ELECTRODE STUDIED BY IN SITU TAPPING MODE AFM.
Boussaad S; Tao NJ; Arechabaleta R. p 397-403
THREE PULSE ECHO PEAK SHIFT MEASUREMENTS ON THE B820 SUBUNIT OF LH1 OF
RHODOSPIRILLUM RUBRUM.
Yu JY; Nagasawa Y; Vangrondelle R; Fleming GR. p 404-410