JOURNAL OF CHEMICAL PHYSICS.
1995, MAY 22, V102, N20.
ISSN 0021-9606.
AR1: MEASURING INTERNAL ELECTRIC FIELDS WITH ATOMIC RESOLUTION.
(English). Article. KOHLER-BE. WOEHL-JC. p 7773
AR2: THEORETICAL ANALYSIS OF THE EMISSION SPECTRA OF THE NACD EXCIMER.
(English). Article. ANGELI-C. PERSICO-M. ALLEGRINI-M. DEFILIPPO-G.
FUSO-F. GRUBER-D. WINDHOLZ-L. MUSSO-M. p 7782
AR3: JET-COOLED FLUORESCENCE EXCITATION SPECTRUM, CARBONYL WAGGING,
AND RING-PUCKERING POTENTIAL ENERGY FUNCTIONS OF 3-CYCLOPENTEN-1-ONE
IN ITS S-1(N,PI-ASTERISK) ELECTRONIC EXCITED STATE. (English). Article.
SAGEAR-P. LAANE-J. p 7789
AR4: INFRARED SPECTROSCOPY, INFRARED PHOTOCONVERSION, AND ULTRAVIOLET
PHOTODISSOCIATION OF NO DIMERS IN NEON AND NITROGEN MATRICES.(English).
Article. LEGAY-F. LEGAYSOMMAIRE-N. p 7798
AR5: THE STRUCTURE AND INTERNAL DYNAMICS OF CO-CO-H2O DETERMINED BY
MICROWAVE SPECTROSCOPY. (English). Article.
PETERSON-KI. SUENRAM-RD. LOVAS-FJ. p 7807
AR6: CALCULATIONS OF THE TUNNELING SPLITTINGS IN WATER DIMER AND
TRIMER USING DIFFUSION MONTE CARLO. (English). Review.
GREGORY-JK. CLARY-DC. p 7817
AR7: THREE DIMENSIONAL QUANTUM CALCULATION OF THE VISIBLE ABSORPTION
SPECTRUM OF AR-3(+). (English). Article.
GADEA-FX. LEQUERE-F. p 7830
AR8: QUANTUM TUNNELING IN AN ANHARMONIC CLASSICAL BATH - ENHANCED
KINETIC ISOTOPE EFFECTS IN AN ARRHENIUS REGION. (English). Article.
DAKHNOVSKII-Y. BURSULAYA-B. KIM-HJ. p 7838
AR9: STATE-SELECTED ION-MOLECULE REACTIONS - STATISTICAL
CALCULATIONS WITH CONSTRAINTS. (English). Article.
UITERWAAL-CJGJ. VANECK-J. NIEHAUS-A. p 7850
AR10: LASER INITIATED HALF REACTION STUDY OF H+O-2-)OH+O.
(English). Article. HONMA-K. p 7856
AR11: VB RESONANCE THEORY IN SOLUTION .1. MULTISTATE
FORMULATION. (English). Review. BIANCO-R. HYNES-JT. p 7864
AR12: VB RESONANCE THEORY IN SOLUTION .2.
I-2(-)REVERSIBLE-ARROW-I+I- IN ACETONITRILE. (English).
Article. BIANCO-R. HYNES-JT. p 7885
AR13: THE MECHANISM OF THE UNIMOLECULAR DISSOCIATION OF
TRICHLOROETHYLENE CHCL=CCL2 IN THE GROUND ELECTRONIC STATE.
(English). Article.YOKOYAMA-K.FUJISAWA-G.YOKOYAMA-A. p 7902
AR14: MOLECULAR DYNAMICS STUDIES OF THE THERMAL DECOMPOSITION OF
2,3-DIAZABICYCLO(2.2.1)HEPT-2-ENE. (English). Article.
SORESCU-DC. THOMPSON-DL. RAFF-LM. p 7910
AR15: KINETIC ENERGY ANALYSIS OF (HI)(N) CLUSTER PHOTOFRAGMENTS.
(English). Article. YOUNG-MA. p 7925
AR16: EFFECTS OF SOLVENT POLARIZATION RELAXATION ON NONADIABATIC
OUTERSPHERE ELECTRON TRANSFER REACTIONS IN ULTRAFAST DIPOLAR
SOLVENTS. (English). Article. ROY-S. BAGCHI-B. p 7937
AR17: DYNAMICAL ANGULAR MOMENTUM MODELS FOR ROTATIONAL TRANSFER
IN POLYATOMIC MOLECULES. (English). Article.ALWAHABI-ZT.
BESLEY-NA. MCCAFFERY-AJ. OSBORNE-MA. RAWI-Z. p 7945
AR18: THE ENERGY-DEPENDENT TRANSMISSION COEFFICIENT AND THE
ENERGY DISTRIBUTION OF CLASSICAL PARTICLES ESCAPING FROM A
METASTABLE WELL. (English). Article.
BADER-JS. BERNE-BJ. p 7953
AR19: THE INITIAL VIBRATIONAL STATE DISTRIBUTION OF HCN
(X)OVER-TILDE(1)SIGMA(+)(V(1),O,V(3)) FROM THE REACTION
CN((2)SIGMA(+))+C2H6-)HCN+C2H5. (English). Article.
BETHARDY-GA. NORTHRUP-FJ. MACDONALD-RG. p 7966
AR20: ONE-DIMENSIONAL CHEMICAL MASTER EQUATIONS - UNIQUENESS AND
ANALYTICAL FORM OF CERTAIN SOLUTIONS. (English). Article.
SAMOILOV-M. ROSS-J. p 7983
AR21: EXTRACTION OF DYNAMICS FROM THE RESONANCE STRUCTURE OF
HEH2+ SPECTRA. (English). Article.
MANDELSHTAM-VA.TAYLOR-HS. JUNG-C. BOWEN-HF. KOURI-DJ. p 7988
AR22: COMPETITIVE TRACKING OF MOLECULAR OBJECTIVES DESCRIBED BY
QUANTUM MECHANICS. (English). Article.
CHEN-Y. GROSS-P. RAMAKRISHNA-V. RABITZ-H. MEASE-K. p 8001
AR23: EXTRACTION, THROUGH FILTER-DIAGONALIZATION, OF GENERAL
QUANTUM EIGENVALUES OR CLASSICAL NORMAL MODE FREQUENCIES FROM A
SMALL NUMBER OF RESIDUES OR A SHORT-TIME SEGMENT OF A SIGNAL .1.
THEORY AND APPLICATION TO A QUANTUM-DYNAMICS MODEL. (English).
Article. WALL-MR. NEUHAUSER-D. p 8011
AR24: APPLICATION OF GRADIENT-CORRECTED DENSITY FUNCTIONAL
THEORY TO THE STRUCTURES AND THERMOCHEMISTRIES OF SCF3, TIF4, VF5,
AND CRF6. (English). Article.
RUSSO-TV. MARTIN-RL. HAY-PJ. p 8023
AR25: MP2/6-311++G(D,P) STUDY OF TEN IONIC HYDROGEN-BONDED
BINARY SYSTEMS - STRUCTURES, NORMAL MODES, THERMODYNAMICS, AND
COUNTERPOISE ENERGIES.(English).Article.PUDZIANOWSKI-AT. p 8029
AR26: APPLICATION OF PAIR CORRELATION THEORY TO POSITRONIUM
COMPOUNDS. (English). Article.SAITO-SL. SASAKI-F. p 8040
AR27: AB INITIO POLARIZABILITY STUDY OF POLYPYRROLE. (English).
Article. TOTO-JL. TOTO-TT. DEMELO-CP. ROBINS-KA. p 8048
AR28: LOWER BOUND FOR THE NONRELATIVISTIC GROUND STATE ENERGY OF
THE LITHIUM ATOM. (English). Article. KING-FW. p 8053
AR29: UNITARY GROUP BASED STATE SPECIFIC OPEN-SHELL-SINGLET
COUPLED-CLUSTER METHOD - APPLICATION TO OZONE AND COMPARISON WITH
HILBERT AND FOCK SPACE THEORIES. (English). Article.
LI-XZ. PALDUS-J. p 8059
AR30: SYMPLECTIC REVERSIBLE INTEGRATORS - PREDICTOR CORRECTOR
METHODS. (English). Article.MARTYNA-GJ. TUCKERMAN-ME. p 8071
AR31: RELATIVISTIC AB INITIO MODEL POTENTIAL CALCULATIONS
INCLUDING SPIN-ORBIT EFFECTS THROUGH THE WOOD-BORING HAMILTONIAN.
(English). Article. SEIJO-L. p 8078
AR32: CHEMICAL ASSOCIATION IN SIMPLE MODELS OF MOLECULAR AND
IONIC FLUIDS .4. NEW APPROXIMATION FOR THE CAVITY FUNCTION AND AN
APPLICATION TO THE THEORY OF WEAK ELECTROLYTES.(English).
Article. ZHOU-YQ. STELL-G. p 8089
AR33: ROTATIONAL DYNAMICS OF AXIALLY SYMMETRIC SOLUTES IN
ISOTROPIC LIQUIDS .1. A COLLECTIVE CAGE DESCRIPTION FROM
MOLECULAR DYNAMICS SIMULATIONS. (English). Article.
POLIMENO-A. MORO-GJ. FREED-JH. p 8094
AR34: LIQUID-CRYSTAL PHASE DIAGRAM OF THE GAY-BERNE FLUID BY
PERTURBATION THEORY. (English). Article.
VELASCO-E. SOMOZA-AM. MEDEROS-L. p 8107
AR35: LOW-ENERGY EXCITATIONS IN GLASS-FORMING AQUEOUS
LITHIUM-CHLORIDE. (English). Article. ACHIBAT-T. DUVAL-E.
DUPUYPHILON-J. JAL-JF. PREVEL-B. ZORKANI-I. p 8114
AR36: CRITICAL PHENOMENA IN IONIC FLUIDS - A SYSTEMATIC
INVESTIGATION OF THE CROSSOVER BEHAVIOR. (English). Article.
NARAYANAN-T. PITZER-KS. p 8118
AR37: TEST OF A SIMPLE MODEL OF THE INTERMOLECULAR POTENTIAL OF
C-60 ON THE SERIES OF KNC60, O-LESS-THAN-N-LESS-THAN-OR-EQUAL-TO-6,
CRYSTALS. (English). Article. GAMBA-Z. MARTINEZ-G. p 8132
AR38: THE KINETICS OF CRYSTAL GROWTH AND DISSOLUTION FROM THE
MELT IN LENNARD-JONES SYSTEMS.(English).Article.
BAEZ-LA. CLANCY-P. p 8138
AR39: COMPATIBILIZING A/B BLENDS WITH AB DIBLOCK COPOLYMERS -
EFFECT OF COPOLYMER MOLECULAR WEIGHT. (English). Article.
ISRAELS-R. JASNOW-D. BALAZS-AC. GUO-L. KRAUSCH-G. SOKOLOV-J.
RAFAILOVICH-M. p 8149
AR40: ADSORPTION AND REACTION OF CH3COOH AND CD3COOD ON THE
MGO(100) SURFACE - A FOURIER TRANSFORM INFRARED AND TEMPERATURE
PROGRAMMED DESORPTION STUDY.(English).Article.XU-C.KOEL-BE.p 8158
AR41: ELECTRONIC STRUCTURE OF PRISTINE AND SODIUM-DOPED
CYANO-SUBSTITUTED POLY(2,5-DIHEXYLOXY-P-PHENYLENEVINYLENE) - A
COMBINED EXPERIMENTAL AND THEORETICAL STUDY. (English).Article.
FAHLMAN-M. BROMS-P. DOSSANTOS-DA. MORATTI-SC. JOHANSSON-N.
XING-K. FRIEND-RH. HOLMES-AB. BREDAS-JL. SALANECK-WR. p 8167
AR42: SPATIOTEMPORAL CONCENTRATION PATTERNS ASSOCIATED WITH THE
CATALYTIC OXIDATION OF CO AND AU COVERED PT(110) SURFACES.
(English). Article. ASAKURA-K. LAUTERBACH-J. ROTERMUND-HH.
ERTL-G. p 8175
AR43: SURFACE PHONONS ON RU(001) OBSERVED BY ELECTRON ENERGY
LOSS SPECTROSCOPY IN THE PRESENCE OF ORDERED OXYGEN OVERLAYERS.
(English).Article.MITCHELL-WJ.WANG-YQ.SCHICK-M.WEINBERG-WH.p 8185
AR44: SUCCESSIVE CAPTURE AND COAGULATION OF ATOMS AND MOLECULES
TO SMALL CLUSTERS IN LARGE LIQUID HELIUM CLUSTERS. (English).
Article. LEWERENZ-M. SCHILLING-B. TOENNIES-JP. p 8191
AR45: THE SIMPLE THEORY OF DEMIXATION IN THE PRESENCE OF
AMPHIPHILE.(English).Article.MOSKALENKO-A. DAWSON-KA. p 8208
AR46: MOLECULAR RELAXATION AND EXCESS ENTROPY IN LIQUIDS AND
THEIR CONNECTION TO THE STRUCTURE OF GLASS. (English). Article.
MURTHY-SSN. PAIKARAY-A. ARYA-N. p 8213
AR47: MONTE CARLO STUDY OF MELTING AND DISORDERING IN MONOLAYER
FILMS FORMED ON THE (100) FACE OF FACE CENTERED CUBIC CRYSTALS.
(English). Article. PATRYKIEJEW-A. SOKOLOWSKI-S.
ZIENTARSKI-T. BINDER-K. p 8221
AR48: HOT ELECTRON MEDIATED PHOTODESORPTION - A TIME-DEPENDENT
APPROACH APPLIED TO NO/PT(111). (English). Article.
HARRIS-SM. HOLLOWAY-S. DARLING-GR. p 8235
AR49: BARRIERS FOR HYDROGEN ATOM DIFFUSION ON THE SI(100)-2X1
SURFACE. (English). Article.NACHTIGALL-P. JORDAN-KD. p 8249
AR50: MOLECULAR BEAM STUDY OF DISSOCIATIVE STICKING OF METHANE
ON NI(100). (English). Article.
HOLMBLAD-PM. WAMBACH-J. CHORKENDORFF-I. p 8255
AR51: CH4 DISSOCIATION ON NI(100) - COMPARISON OF A DIRECT
DYNAMICAL MODEL TO MOLECULAR BEAM EXPERIMENTS. (English).
Article. LUNTZ-AC. p 8264
AR52: ACCURATE AB INITIO TOTAL ATOMIZATION ENERGIES OF THE C-N
CLUSTERS (N=2-10).(English).Note.MARTIN-JML. TAYLOR-PR. p 8270
AR53: MACROMIXING EFFECTS ON THE KUMPINSKY-EPSTEIN MODEL OF A
CHLORITE-IODIDE REACTION IN A STIRRED TANK. (English). Note.
HSU-TJ. LEE-DJ. p 8274
AR54: A COMBINED DENSITY FUNCTIONAL THEORETICAL AND
PHOTOELECTRON SPECTROSCOPIC STUDY OF GE2O2. (English). Note.
NICHOLAS-JB. FAN-JW. WU-HB. COLSON-SD. WANG-LS. p 8277
AR55: A DENSITY FUNCTIONAL MOLECULAR DYNAMICS STUDY OF THE
STRUCTURE OF LIQUID NITROMETHANE. (English). Note.
SEMINARIO-JM. CONCHA-MC. POLITZER-P. p 8281
AR56: TOWARD DETERMINING THE TRUE HARD-SPHERE INTERFACIAL FREE
ENERGY. (English). Note. MARR-DWM. p 8283