Journal of Physical Chemistry.
1997, V 101, N 7, Feb 13.
ISSN 0022-3654
CORRELATED CAPPED SUBSYSTEM METHOD FOR THE CALCULATION OF SUBSTITUENT
EFFECTS ON BOND ENERGIES. [Letter]
Noland M; Coitino EL; Truhlar DG. pp 1193-1197
HYDRATION MODEL FOR THE ENERGY BARRIER IN SELF-EXCHANGE ELECTRON TRANSFER
REACTIONS IN SOLUTION.
Bu YX; Deng CH. pp 1198-1205
POTENTIAL ENERGY SURFACE OF THE O(D-1)+N2O-]2NO, O-2+N-2 REACTIONS.
Last I; Aguilar A; Sayos R; Gonzalez M; Gilibert M. pp 1206-1215
REACTION AND QUENCHING OF CL(P-2(J)) ATOMS IN COLLISIONS WITH METHANE AND
DEUTERATED METHANES.
Matsumi Y; Izumi K; Skorokhodov V; Kawasaki M; Tanaka N. pp 1216-1221
ION FRAGMENT IMAGING OF THE ION-PAIR PHOTODISSOCIATION OF CH3CL, CH3BR,
C2H5CL, AND C2H5BR AT 118 NM.
Suto K; Sato Y; Reed CL; Skorokhodov V; Matsumi Y; Kawasaki M.
pp 1222-1226
PHOTOFRAGMENT IMAGING OF CH3BR+ FROM (CH3BR)(2)(+) AT 355 NM.
Suto K; Sato Y; Matsumi Y; Kawasaki M. pp 1227-1230
PHOTOFRAGMENTATION OF ACETYL CYANIDE AT 193 NM.
Horwitz RJ; Francisco JS; Guest JA. pp 1231-1237
COLLISION-INDUCED DISSOCIATION MEASUREMENTS ON LI+(H2O)(N), N=1-6 - THE
FIRST DIRECT MEASUREMENT OF THE LI+-OH2 BOND ENERGY.
Rodgers MT; Armentrout PB. pp 1238-1249
ADSORPTION OF ORGANIC MOLECULES ON LARGE WATER CLUSTERS.
Ahmed M; Apps CJ; Hughes C; Watt NE; Whitehead JC. pp 1250-1253
ADSORPTION OF NXOY-BASED MOLECULES ON LARGE WATER CLUSTERS - AN
EXPERIMENTAL AND THEORETICAL STUDY.
Ahmed M; Apps CJ; Buesnel R; Hughes C; Hillier IH; Watt NE; Whitehead JC.
pp 1254-1259
UV-INDUCED ROTAMERIZATION AND VIBRATIONAL SPECTRA OF THE CONFORMERS OF
CYANOMETHYL FORMATE - MATRIX ISOLATION INFRARED AND AB INITIO STUDIES.
Dahlqvist M; Hotokka M; Rasanen M. pp 1260-1266
FULLERENE FORMATION IN CARBON ARC - ELECTRODE GAP DEPENDENCE AND PLASMA
SPECTROSCOPY.
Huczko A; Lange H; Byszewski P; Poplawska M; Starski A. pp 1267-1269
THE DIMETHYLAMINE DIMER ION IS AN ION-RADICAL COMPLEX - A COMBINED
TPEPICO, VARIATIONAL RRKM, AND AB INITIO MO STUDY OF THE FRAGMENTATION OF
IONIZED DIMERS OF DIMETHYLAMINE.
Mayer PM; Keister JW; Baer T; Evans M; Ng CY; Hsu CW. pp 1270-1276
DIFFUSE REFLECTANCE INFRARED STUDIES OF THE REACTION OF SYNTHETIC SEA SALT
MIXTURES WITH NO2 - A KEY ROLE FOR HYDRATES IN THE KINETICS AND MECHANISM.
Langer S; Pemberton RS; Finlaysonpitts BJ. pp 1277-1286
EXPERIMENTAL AND THEORETICAL EVIDENCE FOR THE ISOLATION OF THORIUM HYDRIDE
MOLECULES IN ARGON MATRICES.
Souter PF; Kushto GP; Andrews L; Neurock M. pp 1287-1291
FLUORESCENCE QUENCHING BY OXYGEN - LACK OF EVIDENCE FOR THE COMPLEX
FORMATION OF OXYGEN WITH 9-CYANOANTHRACENE AND ANTHRACENE IN A SUPERSONIC
FREE JET.
Graf U; Niikura H; Hirayama S. pp 1292-1298
MOLECULAR DYNAMICS STUDY OF A CRYSTALLINE CLUSTER UNDERGOING A
SECOND-ORDER TRANSITION - AN INCHOATE MODEL OF ACETYLENE.
Santikary P; Bartell LS. pp 1299-1304
TEMPERATURE COEFFICIENTS OF THE RATE OF CL ATOM REACTION WITH HBR IN THE
228-368 K RANGE AT MILLITORR PRESSURES.
Dobis O; Benson SW. pp 1305-1312
CHANGE OF THE SHAPE OF A CHEMICAL VORTEX DUE TO A LOCAL DISTURBANCE.
Aliev RR; Davydov VA; Ohmori T; Nakaiwa M; Yamaguchi T. pp 1313-1316
QUENCHING ANALYSIS OF THE PERMANGANATE-HYDROXYLAMINE OSCILLATOR.
Nagy A; Sorensen PG; Hynne F. pp 1317-1323
MANGANESE(II)-SUPEROXIDE COMPLEX IN AQUEOUS SOLUTION.
Jacobsen F; Holcman J; Sehested K. pp 1324-1328
RATE OF HYDROGEN ATOM REACTION WITH ETHANOL, ETHANOL-D(5), 2-PROPANOL, AND
2-PROPANOL-D(7) IN AQUEOUS SOLUTION.
Mezyk SP; Bartels DM. pp 1329-1333
THRESHOLD ENERGY AND UNIMOLECULAR RATE CONSTANT FOR ELIMINATION OF HF FROM
CHEMICALLY ACTIVATED CF3CF2CH3 - EFFECT OF THE CF3 SUBSTITUENT ON THE
ALPHA-CARBON.
Mcdoniel JB; Holmes BE. pp 1334-1337
LOW-TEMPERATURE RATE COEFFICIENTS FOR REACTIONS OF ETHYNYL RADICAL (C2H)
WITH PROPANE, ISOBUTANE, N-BUTANE, AND NEOPENTANE.
Hoobler RJ; Opansky BJ; Leone SR. pp 1338-1342
PREDICTION OF THE SENSES OF HELICAL AMPHIPHILIC ASSEMBLIES FROM EFFECTIVE
INTERMOLECULAR PAIR POTENTIAL - STUDIES ON CHIRAL MONOLAYERS AND BILAYERS.
Nandi N; Bagchi B. pp 1343-1351
ASSESSMENT OF PROCEDURES FOR CALCULATING RADICAL HYPERFINE STRUCTURES.
[Review]
Gauld JW; Eriksson LA; Radom L. pp 1352-1359
COMPARISON OF HARTREE-FOCK, DENSITY FUNCTIONAL, MOLLER-PLESSET
PERTURBATION, COUPLED CLUSTER, AND CONFIGURATION INTERACTION METHODS FOR
THE MIGRATORY INSERTION OF NITRIC OXIDE INTO A COBALT-CARBON BOND.
Niu SQ; Hall MB. pp 1360-1365
IR STUDY OF HYDROGEN BONDS IN HALOGENOALCOHOL-WATER MIXTURES.
Mizuno K; Mabuchi K; Miyagawa T; Matsuda Y; Kita S; Kaida M; Shindo Y.
pp 1366-1369
AB INITIO DENSITY FUNCTIONAL CALCULATIONS OF DEUTERIUM KINETIC ISOTOPE
EFFECTS FOR DECOMPOSITION OF DIMETHYLNITRAMINE.
Harris NJ; Lammertsma K. pp 1370-1373
BORON DIBROMIDE AND BORON DIIODIDE GROUND STATE NEUTRAL AND CATION - USE
OF EFFECTIVE CORE POTENTIALS COMBINED WITH AB INITIO AND DENSITY
FUNCTIONAL THEORY.
Lee EPF; Wright TG. pp 1374-1377
NATURE OF CYCLOBUTANE BONDS IN THE NEUTRAL [2+2] DIMER OF C-60.
Osawa S; Sakai M; Osawa E. pp 1378-1383
GRADIENT LINE REACTION PATHS FOR HINDERED INTERNAL ROTATION IN H2BNH2 AND
INVERSION IN PF3.
Minyaev RM; Wales DJ; Walsh TR. pp 1384-1392
ELECTRONIC STRUCTURE AND DYNAMIC PROPERTIES OF SOLID ALKALI CYANIDES.
Buljan A; Alemany P; Ruiz E. pp 1393-1399
HIGH-LEVEL ELECTRON CORRELATION CALCULATIONS ON FORMAMIDE AND THE
RESONANCE MODEL.
Fogarasi G; Szalay PG. pp 1400-1408
RING CURRENTS AND AROMATICITY OF MONOCYCLIC PI-ELECTRON SYSTEMS C6H6,
B3N3H6, B3O3H3, C3N3H3, C5H5-, C7H7+, C3N3F3, C6H3F3, AND C6F6.
Fowler PW; Steiner E. pp 1409-1413
PHOTOIONIZATION OF (P-ALKYLPHENYL)TRIPHENYLPORPHYRINS IN NEUTRAL AND
POSITIVELY AND NEGATIVELY CHARGED VESICLES - EFFECTS OF ALKYL CHAIN LENGTH
AND ADDITION OF CHLOROALKANES.
Sungsuh HM; Kevan L. pp 1414-1418