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Results: 401-425/13055
Authors:
SCHWEGLER E
CHALLACOMBE M
HEADGORDON M
Citation: E. Schwegler et al., A MULTIPOLE ACCEPTABILITY CRITERION FOR ELECTRONIC-STRUCTURE THEORY, The Journal of chemical physics, 109(20), 1998, pp. 8764-8769
Authors:
DEY BK
ASKAR A
RABITZ H
Citation: Bk. Dey et al., MULTIDIMENSIONAL WAVE-PACKET DYNAMICS WITHIN THE FLUID DYNAMICAL FORMULATION OF THE SCHRODINGER-EQUATION, The Journal of chemical physics, 109(20), 1998, pp. 8770-8782
Authors:
GOMEZ MA
PRATT LR
Citation: Ma. Gomez et Lr. Pratt, CONSTRUCTION OF SIMULATION WAVE-FUNCTIONS FOR AQUEOUS SPECIES - D3O+, The Journal of chemical physics, 109(20), 1998, pp. 8783-8789
Authors:
YOSHIMORI A
Citation: A. Yoshimori, COMPARISONS OF SEMICLASSICAL APPROXIMATIONS BY EXPANSION IN PLANCKS-CONSTANT, The Journal of chemical physics, 109(20), 1998, pp. 8790-8800
Authors:
PRUDENTE FV
ACIOLI PH
NETO JJS
Citation: Fv. Prudente et al., THE FITTING OF POTENTIAL-ENERGY SURFACES USING NEURAL NETWORKS - APPLICATION TO THE STUDY OF VIBRATIONAL LEVELS OF H-3(+), The Journal of chemical physics, 109(20), 1998, pp. 8801-8808
Authors:
STULTZ CM
KARPLUS M
Citation: Cm. Stultz et M. Karplus, ON THE POTENTIAL SURFACE OF THE LOCALLY ENHANCED SAMPLING APPROXIMATION, The Journal of chemical physics, 109(20), 1998, pp. 8809-8815
Authors:
LUSTIG R
Citation: R. Lustig, MICROCANONICAL MONTE-CARLO SIMULATION OF THERMODYNAMIC PROPERTIES, The Journal of chemical physics, 109(20), 1998, pp. 8816-8828
Authors:
PARTHASARATHY R
FINCH CD
WOLFGANG J
NORDLANDER P
DUNNING FB
Citation: R. Parthasarathy et al., LOW-ENERGY DISSOCIATIVE ELECTRON-ATTACHMENT TO CH2BR2, CHCLBR2, AND CCL3BR - INTERMEDIATE LIFETIMES AND DECAY ENERGETICS, The Journal of chemical physics, 109(20), 1998, pp. 8829-8835
Authors:
CHUANG CC
TSANG SN
KLEMPERER W
CHANG HC
Citation: Cc. Chuang et al., VIBRATIONAL PREDISSOCIATION DYNAMICS OF ARHF (3000) AND (3110) - LIFETIMES AND HF PRODUCT STATE DISTRIBUTIONS, The Journal of chemical physics, 109(20), 1998, pp. 8836-8841
Authors:
FRANCE MR
PULLINS SH
DUNCAN MA
Citation: Mr. France et al., PHOTODISSOCIATION SPECTROSCOPY OF THE CA-C2H2 AND CA+-C2D2 PI-COMPLEXES(), The Journal of chemical physics, 109(20), 1998, pp. 8842-8850
Authors:
SUN F
KOSTEREV A
SCOTT G
LITOSH V
CURL RF
Citation: F. Sun et al., NU(1) AND NU(1)- DETERMINATION OF THE NU(5) ENERGY AND THE QUASILINEARITY OF DCCN(NU(5) OF DCCN ), The Journal of chemical physics, 109(20), 1998, pp. 8851-8856
Authors:
LARSEN JJ
MORKBAK NJ
OLESEN J
BJERRE N
MACHHOLM M
KEIDING SR
STAPELFELDT H
Citation: Jj. Larsen et al., FEMTOSECOND PHOTODISSOCIATION DYNAMICS OF I-2 STUDIED BY ION IMAGING, The Journal of chemical physics, 109(20), 1998, pp. 8857-8863
Authors:
PETERSON KA
Citation: Ka. Peterson, ACCURATE AB-INITIO NEAR-EQUILIBRIUM POTENTIAL-ENERGY AND DIPOLE-MOMENT FUNCTIONS OF THE X B-2(1) AND FIRST EXCITED (2)A(2) ELECTRONIC STATES OF OCLO AND OBRO, The Journal of chemical physics, 109(20), 1998, pp. 8864-8875
Authors:
RICHTER RC
ROSENDAHL AR
HYNES PJ
LEE EPF
Citation: Rc. Richter et al., S-2(A(1)DELTA) PRODUCTION IN THE REACTION OF S D-1 ATOMS WITH COS - SPECTROSCOPY AND DYNAMICS, The Journal of chemical physics, 109(20), 1998, pp. 8876-8886
Authors:
CHAKRABORTY D
HSU CC
LIN MC
Citation: D. Chakraborty et al., THEORETICAL-STUDIES OF NITROAMINO RADICAL REACTIONS - RATE CONSTANTS FOR THE UNIMOLECULAR DECOMPOSITION OF HNNO2 AND RELATED BIMOLECULAR PROCESSES, The Journal of chemical physics, 109(20), 1998, pp. 8887-8896
Authors:
MARDIS KL
SIBERT EL
Citation: Kl. Mardis et El. Sibert, THE EFFECT OF NONADIABATIC COUPLING ON THE CALCULATION OF N(E,J) FOR THE METHANE ASSOCIATION REACTION, The Journal of chemical physics, 109(20), 1998, pp. 8897-8906
Authors:
MARTINEZNUNEZ E
VAZQUEZ SA
Citation: E. Martineznunez et Sa. Vazquez, DYNAMICAL STUDY OF THE DISSOCIATION AND ELIMINATION CHANNELS IN THE DECOMPOSITION OF METHYL NITRITE, The Journal of chemical physics, 109(20), 1998, pp. 8907-8919
Authors:
YANG X
DAGDIGIAN PJ
Citation: X. Yang et Pj. Dagdigian, ELECTRONIC SPECTROSCOPY OF THE AL-H-2 COMPLEX - EXCITED-STATE DYNAMICS AND ORBITAL ALIGNMENT OF THE ALH(A (1)PI) PRODUCT, The Journal of chemical physics, 109(20), 1998, pp. 8920-8928
Authors:
TAKAYANAGI T
KUROSAKI Y
Citation: T. Takayanagi et Y. Kurosaki, VAN-DER-WAALS RESONANCES IN CUMULATIVE REACTION PROBABILITIES FOR THEF-2, D-2, AND HD REACTIONS(H), The Journal of chemical physics, 109(20), 1998, pp. 8929-8934
Authors:
WU QF
LU WY
YANG SH
Citation: Qf. Wu et al., DEHYDROGENATION AND PHYSISORPTION OF SATURATED-HYDROCARBONS (N-BUTANEAND ISOBUTANE) ON NB-X(+), The Journal of chemical physics, 109(20), 1998, pp. 8935-8939
Authors:
FLENIKEN J
KIM Y
MEYER H
Citation: J. Fleniken et al., 2-PHOTON SPECTROSCOPY OF THE NO-NE COMPLEX, The Journal of chemical physics, 109(20), 1998, pp. 8940-8947
Authors:
CHAN WT
HAMILTON IP
Citation: Wt. Chan et Ip. Hamilton, PROTONATED FLUORINE, HF2- AB-INITIO POTENTIAL-ENERGY SURFACE AND VIBRATIONAL SPLITTINGS FOR PROTON-TRANSFER( ), The Journal of chemical physics, 109(20), 1998, pp. 8948-8952
Authors:
HUANG MB
WANG ZX
Citation: Mb. Huang et Zx. Wang, DENSITY-FUNCTIONAL AND AB-INITIO STUDY OF THE KETENE AND METHYLKETENERADICAL CATIONS, The Journal of chemical physics, 109(20), 1998, pp. 8953-8958
Authors:
SCHMID RP
GANOT Y
BAR I
ROSENWAKS S
Citation: Rp. Schmid et al., COMBINATION BANDS VERSUS OVERTONE STRETCH EXCITATION AND ROTATIONAL EFFECTS IN VIBRATIONALLY MEDIATED PHOTODISSOCIATION OF ACETYLENE, The Journal of chemical physics, 109(20), 1998, pp. 8959-8967
Authors:
BEMISH RJ
OUDEJANS L
MILLER RE
MOSZYNSKI R
HEIJMEN TGA
KORONA T
WORMER PES
VANDERAVOIRD A
Citation: Rj. Bemish et al., INFRARED-SPECTROSCOPY AND AB-INITIO POTENTIAL-ENERGY SURFACE FOR NE-C2H2 AND NE-C2HD COMPLEXES, The Journal of chemical physics, 109(20), 1998, pp. 8968-8979