Journal of Physical Chemistry.
1997, V 101, N 37, Sep 11.
ISSN 0022-3654
THREE-DIMENSIONAL QUANTUM MECHANICAL TREATMENT OF THE REACTION
NE+H-2(+)-]NEH++H. [Letter]
Gilibert M; Blasco RM; Gonzalez M; Gimenez X; Aguilar A;
Last I; Baer M. pp 6821-6823
MAPPING ELECTRON TRANSFER PATHWAYS IN A CHROMOPHORE-QUENCHER TRIAD.
[Letter]
Treadway JA; Chen PY; Rutherford TJ; Keene FR; Meyer TJ. pp 6824-6826
PHOTOSENSITIVE, BUBBLE-FREE, BROMATE-1,4-CYCLOHEXANEDIONE OSCILLATING
REACTIONS - ILLUMINATION CONTROL OF PATTERN FORMATION.
Kurincsorgei K; Zhabotinsky AM; Orban M; Epstein IR. pp 6827-6829
COMBINATION OF PRESSURE AND TEMPERATURE DEPENDENT MEASUREMENTS - A SIMPLE
ACCESS TO INTRINSIC THERMAL ACTIVATION ENERGIES.
Rettig W; Fritz R; Braun D. pp 6830-6835
AMIDE DERIVATIVES OF DMABN - A NEW CLASS OF DUAL FLUORESCENT COMPOUNDS.
Braun D; Rettig W; Delmond S; Letard JF; Lapouyade R. pp 6836-6841
HIGH MAGNETIC FIELD AND MAGNETIC ISOTOPE EFFECTS ON LIFETIMES OF TRIPLET
BIRADICALS CONSISTING OF TWO EQUIVALENT BENZOPHENONE KETYLS LINKED BY
METHYLENE CHAINS.
Fujiwara Y; Aoki T; Haino T; Fukazawa Y; Tanimoto Y; Nakagaki R; Takahira
O; Okazaki M. pp 6842-6849
PHOTOINDUCED GENERATION OF LONG-LIVED PROTON TRANSFER STATES -
PHOTOINDUCED PROTON TRANSFER FROM 2-(2',4'-DINITROBENZYL)PYRIDINE TO A
PROTON CAGE, THE [2.1.1] CRYPTAND.
Kuldova K; Corval A; Trommsdorff HP; Lehn JM. pp 6850-6854
GENERATION AND DECAY OF ARYL SULFINYL AND SULFENYL RADICALS - A TRANSIENT
ABSORPTION AND COMPUTATIONAL STUDY.
Darmanyan AP; Gregory DD; Guo YS; Jenks WS. pp 6855-6863
DIELECTRIC PROPERTIES OF AQUEOUS NACL SOLUTIONS AT MICROWAVE FREQUENCIES.
Nortemann K; Hilland J; Kaatze U. pp 6864-6869
VIBRATIONAL STATE-RESOLVED STUDY OF THE O-+D-2 REACTION - DIRECT DYNAMICS
FROM 0.47 TO 1.20 EV.
Carpenter MA; Farrar JM. pp 6870-6875
OPTICAL AND THERMAL ELECTRON TRANSFER ACTIVATION OF DIOXYGEN BY VIOLOGEN
DITHIOLENE METALATES.
Ammon U; Chiorboli C; Dumler W; Grampp G; Scandola F; Kisch H.
pp 6876-6882
MODEL-INDEPENDENT ESTIMATION OF THE PHOTOKINETIC TRANSFER MATRIX FROM
MATRIX-FORMATTED FREQUENCY-DOMAIN FLUORESCENCE.
Neal SL. pp 6883-6889
MODEL-INDEPENDENT ANALYSIS OF PYRENE PHOTOKINETICS IN SDS MICELLES.
Villegas MM; Neal SL. pp 6890-6896
AB INITIO IONIZATION AND EXCITATION SPECTRA INVOLVING IO(X-2-PI) AND
IO+(X-3-SIGMA(-), A(1)DELTA, B(1)SIGMA(+)).
Hassanzadeh P; Irikura KK; Johnson RD. pp 6897-6902
OPTIMIZATION OF TWO-DIMENSIONAL MULTIPLE-QUANTUM MAS NMR EXPERIMENTS FOR I
= 3/2 NUCLEI ON A MODERATE-FIELD SPECTROMETER.
Hanaya M; Harris RK. pp 6903-6910
MOLECULAR MODELING OF COMBUSTION KINETICS - THE ABSTRACTION OF PRIMARY AND
SECONDARY HYDROGENS BY HYDROXYL RADICAL.
Hu WP; Rossi I; Corchado JC; Truhlar DG. pp 6911-6921
CROSSED MOLECULAR BEAM STUDY OF THE REACTION BR+O-3.
Zhang JS; Miau TT; Lee YT. pp 6922-6930
EXCITED SINGLET-STATE YIELDS IN HYDROCARBON LIQUIDS EXPOSED TO X-RAYS.
Holroyd RA; Preses JM; Hanson JC. pp 6931-6935
GENERALIZED MOLECULAR ORBITAL THEORY .2.
Couty M; Hall MB. pp 6936-6944
SUBSTITUENTS EFFECT ON THE ELECTRONIC PROPERTIES OF ANILINE AND
OLIGOANILINES.
Vaschetto ME; Retamal BA. pp 6945-6950
ACIDITY OF ZEOLITES AND SILANOLS - STUDY OF THE INFLUENCE OF SIZE AND
SOFTNESS OF THE GLOBAL SYSTEM ON THE ELECTRONEGATIVITY-SOFTNESS
COMPETITION IN HALOGENATED MODEL SYSTEMS.
Damoun S; Langenaeker W; Geerlings P. pp 6951-6954
(X)OVER-TILDE(1)A(1), (A)OVER-TILDE(3)B(1), (A)OVER-TILDE(1)B(1), AND
(B)OVER-TILDE(1)A(1) ELECTRONIC STATES OF PH2+.
Vanhuis TJ; Yamaguchi Y; Sherrill CD; Schaefer HF. pp 6955-6963
THEORETICAL PREDICTION OF VIBRATIONAL SPECTRUM OF N-GLYCYLGLYCINE
HYDROCHLORIDE - AN AB INITIO STUDY.
Chakraborty D; Manogaran S. pp 6964-6969
GENERATION OF NITRILE N-SULFIDE (RCNS) RADICAL CATIONS AND NEUTRALS VIA
ION-MOLECULE REACTIONS - TANDEM MASS SPECTROMETRY AND AB INITIO MO STUDY.
Gerbaux P; Vanhaverbeke Y; Flammang R; Wong MW; Wentrup C. pp 6970-6975
NUMERICAL DETERMINATION OF THE TOPOLOGICAL PROPERTIES OF THE ELECTRONIC
CHARGE DENSITY IN MOLECULES AND SOLIDS USING DENSITY FUNCTIONAL THEORY.
Aray Y; Rodriguez J; Rivero J. pp 6976-6982
ASYMMETRICALLY DISTORTED STRUCTURE, SELECTIVE BOND LENGTH ALTERNATION, AND
REACTIONS OF RADICAL CATIONS OF SILACYCLOHEXANES - AN ESR AND AB-INITIO MO
STUDY.
Komaguchi K; Shiotani M. pp 6983-6990
SIMPLIFIED MODELS FOR HARDNESS KERNEL AND CALCULATIONS OF GLOBAL HARDNESS.
Liu SB; Deproft F; Parr RG. pp 6991-6997
AM1 STUDY OF THE GROUND AND EXCITED STATE POTENTIAL ENERGY SURFACES OF
SYMMETRIC CARBOCYANINES.
Rodriguez J; Scherlis D; Estrin D; Aramendia PF; Negri RM. pp 6998-7006
CATION-ETHER COMPLEXES IN THE GAS PHASE - BOND DISSOCIATION ENERGIES OF
M+(DIMETHYL ETHER)(X), X = 1-3, M+(1,2-DIMETHOXYETHANE)(X), X = 1 AND 2,
AND M+(12-CROWN-4) WHERE M = RB AND CS.
More MB; Ray D; Armentrout PB. pp 7007-7017
THEORETICAL STUDIES ON THE GAS-PHASE NUCLEOPHILIC RING OPENING OF
3,4-EPIMINO-, 3,4-EPOXY-, AND 3,4-EPITHIO-1-BUTENE (VOL 101A, PG 2896,
1997). [Correction, Addition]
Lee JK; Kim CK; Lee BS; Lee I. pp 7018