Journal of Physical Chemistry.
1997, V 101, N 47, Nov 20.
ISSN 0022-3654
ULTRAFAST X-RAY AND ELECTRON DIFFRACTION - THEORETICAL CONSIDERATIONS.
Bennun M; Cao JS; Wilson KR. pp 8743-8761
ACCURATE THEORETICAL PREDICTION OF RELATIVE ENERGY - BARRIERS TO
LINEARITY, INVERSION, AND INTERNAL ROTATION IN POLYATOMIC MOLECULES.
Lee JS. pp 8762-8767
TRANSIENT ABSORPTION AND TIME-RESOLVED RAMAN STUDY OF THE PHOTOPHYSICS OF
4-PHENYLPYRIDINE IN SOLUTION.
Buntinx G; Naskrecki R; Didierjean C; Poizat O. pp 8768-8777
VIBRATIONAL-ROTATIONAL SPECTRA OF HNS, NSH, AND THEIR IONS - A THEORETICAL
STUDY.
Gersdorf P. pp 8778-8782
VIBRATIONAL FREQUENCIES AND CONFORMATIONAL STABILITY OF
1,4-CYCLOHEXANEDIONE IN THE GAS PHASE AS STUDIED BY INFRARED AND RAMAN
SPECTROSCOPY AND AB INITIO CALCULATIONS.
Egawa T; Delrosario A; Morris K; Laane J. pp 8783-8787
INFRARED SPECTROSCOPY OF THE C-4 ANION - REASSIGNMENT OF THE 1699.8 CM(-1)
BAND.
Szczepanski J; Vala M; Shen LN; Withey PA; Graham WRM. pp 8788-8792
REACTIONS OF LASER-ABLATED COBALT ATOMS WITH O-2 - INFRARED SPECTRA OF
COBALT OXIDES IN SOLID ARGON.
Chertihin GV; Citra A; Andrews L; Bauschlicher CW. pp 8793-8802
STUDY OF CONSECUTIVE BIRADICALS FROM
2-HYDROXY-2,12-DIMETHYLCYCLODODECANONE BY TR-CIDNP, TREPR, AND LASER FLASH
PHOTOLYSIS.
Morozova OB; Yurkovskaya AV; Tsentalovich YP; Sagdeev PZ; Wu T; Forbes
MDE. pp 8803-8808
INFLUENCE OF MOLECULAR STRUCTURE ON THE RATE OF INTERSYSTEM CROSSING IN
FLEXIBLE BIRADICALS.
Tsentalovich YP; Morozova OB; Avdievich NI; Ananchenko GS;
Yurkovskaya AV; Ball JD; Forbes MDE. pp 8809-8816
QUANTUM DYNAMICAL RATE CONSTANT FOR THE H+O-3 REACTION USING A
SIX-DIMENSIONAL DOUBLE MANY-BODY EXPANSION POTENTIAL ENERGY SURFACE.
Szichman H; Baer M; Varandas AJC. pp 8817-8821
PEROXYNITRIC ACID DECAY MECHANISMS AND KINETICS AT LOW PH.
Regimbal JM; Mozurkewich M. pp 8822-8829
TEMPERATURE AND PRESSURE DEPENDENCE OF THE RATE CONSTANT FOR THE CLO+NO2
REACTION.
Percival CJ; Smith GD; Molina LT; Molina MJ. pp 8830-8833
RH(III)-PHOTOSENSITIZED INTERCONVERSION OF NORBORNADIENE AND
QUADRICYCLANE.
Sluggett GW; Turro NJ; Roth HD. pp 8834-8838
FTIR AND MASS-SPECTROMETRIC MEASUREMENTS OF THE RATE CONSTANT FOR THE
C6H5+H-2 REACTION.
Park J; Dyakov IV; Lin MC. pp 8839-8843
ACTIVATION OF PEPTIDE IONS BY BLACKBODY RADIATION - FACTORS THAT LEAD TO
DISSOCIATION KINETICS IN THE RAPID ENERGY EXCHANGE LIMIT.
Price WD; Williams ER. pp 8844-8852
GROUND- AND EXCITED-STATE PROPERTIES OF MOLECULAR COMPLEXES BETWEEN
ADENINE AND 2,7-DIAZAPYRENE AND ITS N-METHYLATED CATIONS.
Becker HC; Broo A; Norden B. pp 8853-8860
STRUCTURE OF LIQUID N-METHYLACETAMIDE - TEMPERATURE DEPENDENCE OF NMR
CHEMICAL SHIFTS AND QUADRUPOLE COUPLING CONSTANTS.
Ludwig R; Weinhold F; Farrar TC. pp 8861-8870
QUANTUM CHEMICAL STUDY OF THE DIFFERENT FORMS OF NITRIC ACID MONOHYDRATE.
Toth G. pp 8871-8876
DYNAMICS OF THE FOUR-ATOM BO+H-2-]HBO+H REACTION - POTENTIAL ENERGY
SURFACE AND REACTION SELECTIVITY FROM QCT CALCULATIONS.
Sogas J; Alberti M; Gimenez X; Sayos R; Aguilar A. pp 8877-8886
BOND CHARACTERIZATION OF CHROMIUM-FISCHER CARBENE COMPLEXES - A COMBINED
STUDY OF EXPERIMENT AND THEORY. [Review]
Wang CC; Wang Y; Liu HJ; Lin KJ; Chou LK; Chan KS. pp 8887-8901
EXCITATION AND STABILITY OF ULTRAHIGH RYDBERG STATES IN STRAY ELECTRIC
FIELDS.
Bellomo P; Farrelly D; Uzer T. pp 8902-8907
SOLID-STATE NMR AND DENSITY FUNCTIONAL INVESTIGATION OF CARBON-13
SHIELDING TENSORS IN METAL-OLEFIN COMPLEXES.
Havlin R; Mcmahon M; Srinivasan R; Le HB; Oldfield E. pp 8908-8913
EQUILIBRIUM GEOMETRIES AND ELECTRONIC STRUCTURE OF IRON-PORPHYRIN
COMPLEXES - A DENSITY FUNCTIONAL STUDY.
Rovira C; Kunc K; Hutter J; Ballone P; Parrinello M. pp 8914-8925
PERIODIC HARTREE-FOCK STUDY OF LIXTIS2,
0-LESS-THAN-OR-EQUAL-TO-X-LESS-THAN-OR-EQUAL-TO-1 - THE STRUCTURAL,
PLASTIC, AND ELECTRONIC EFFECTS OF LITHIUM INTERCALATION IN TIS2.
Clerc DG; Poshusta RD; Hess AC. pp 8926-8931
RYDBERG STATES OF H-4.
Nelson MR; Cobb MG; Borkman RF. pp 8932-8934
APPLICATION OF ISODESMIC REACTIONS TO THE CALCULATION OF THE ENTHALPIES OF
H-CENTER-DOT AND OH-CENTER-DOT ADDITION TO DNA BASES - ESTIMATED HEATS OF
FORMATION OF DNA BASE RADICALS AND HYDRATES.
Colson AO; Becker D; Eliezer I; Sevilla MD. pp 8935-8941
INTERACTION OF ALKENE RADICAL CATIONS WITH SOLVENT MOLECULES AS DESCRIBED
WITH DENSITY FUNCTIONAL THEORY.
Mohr M; Zipse H; Marx D; Parrinello M. pp 8942-8948
SUCCESSIVE OH BINDING ENERGIES OF M(OH)(N)(+) FOR N=1-3 AND M=SC, TI, V,
CO, NI, AND CU.
Ricca A; Bauschlicher CW. pp 8949-8955
MOLECULAR STRUCTURE AND C-O STRETCH FREQUENCIES OF THE COBALT CARBONYLS
CO(CO)(N), N=1, 4, AS STUDIED BY DENSITY FUNCTIONAL THEORY.
Ryeng H; Gropen O; Swang O. pp 8956-8958
SOME HAZARDS OF ELECTRONEGATIVITY CORRELATIONS.
Becerra R; Walsh R. pp 8959-8963
STIRRING EFFECTS AND PHASE-DEPENDENT INHOMOGENEITY IN CHEMICAL
OSCILLATIONS - THE BELOUSOV-ZHABOTINSKY REACTION IN A CSTR - COMMENTS.
Vanag VK. pp 8964-8965
STIRRING EFFECTS AND PHASE-DEPENDENT INHOMOGENEITY IN CHEMICAL
OSCILLATIONS - THE BELOUSOV-ZHABOTINSKY REACTION IN A CSTR - COMMENTS.
Menzinger M; Ali F. pp 8966