Chemical Physics.
1997, V 224, N 2-3, Dec 1.
ISSN 0301-0104
AN INCREMENTAL APPROACH FOR CORRELATION CONTRIBUTIONS TO THE STRUCTURAL
AND COHESIVE PROPERTIES OF POLYMERS - COUPLED-CLUSTER STUDY OF
TRANS-POLYACETYLENE.
Yu M; Kalvoda S; Dolg M. p 121-131
AB INITIO NMR CHEMICAL SHIELDINGS IN THE NEUTRAL AND CHARGED
7-PHOSPHABICYCLO[2.2.1]HEPTANE, -HEPTENE, AND -HEPTADIENE SYSTEMS - THE
LARGEST PREDICTED DOWNFIELD SHIFT FOR A CONVENTIONAL ORGANOPHOSPHORUS
MOLECULE.
Chesnut DB. p 133-141
THEORETICAL AND EXPERIMENTAL INVESTIGATIONS OF THE ELECTRONIC CIRCULAR
DICHROISM AND ABSORPTION SPECTRA OF BICYCLIC KETONES.
Pulm F; Schramm J; Hormes J; Grimme S; Peyerimhoff SD. p 143-155
HEI PHOTOELECTRON SPECTRA OF PH2 AND PF2 - COMPARISON BETWEEN SIMULATION
AND EXPERIMENT.
Chau FT; Dyke JM; Lee EPF; Ridha A; Wang DC. p 157-173
POLARIZATION PROPAGATOR STUDY OF ELECTRONIC EXCITATION IN KEY HETEROCYCLIC
MOLECULES II - FURAN.
Trofimov AB; Schirmer J. p 175-190
THE GEOMETRIC STRUCTURE AND STABILITY OF THE NO+CENTER-DOT-CH4 CATIONIC
COMPLEX.
Lee EPF; Mack P; Wright TG. p 191-199
SINGLE DETERMINANT CALCULATIONS OF EXCITED STATE POLARIZABILITIES.
Jonsson D; Norman P; Agren H. p 201-214
DYNAMICAL MECHANISM FOR THE INTERMOLECULAR RELAXATION OF THE EXCITED NH
STRETCHING VIBRATION OF A PYRROLE MOLECULE IN LIQUID SOLUTION.
Munozcrego C; Santamaria J. p 215-227
THE MANIFESTATION OF DEGENERATE ELECTRON EXCHANGE IN STIMULATED NUCLEAR
POLARIZATION AT HIGH MAGNETIC FIELDS.
Gorelik VR; Morozov VA; Lukzen NN; Bagryanskaya EG; Sagdeev RZ.
p 229-241
A THEORETICAL TREATMENT FOR THE DYNAMICS OF NEAR-RESONANT CHARGE EXCHANGE
IN GAS-SURFACE SCATTERING.
Guan D; Yi XZ; Ding SL; Yang BH; Olson JA. p 243-252
MELTING CURVE FOR ARGON CALCULATED FROM PURE THEORY.
Solca J; Dyson AJ; Steinebrunner G; Kirchner B; Huber H. p 253-261
THE APPLICATION OF SIMULATED ANNEALING TO THE CONFORMATIONAL ANALYSIS OF
DISACCHARIDES.
Naidoo KJ; Brady JW. p 263-273
SPECTRAL ANALYSIS OF THE FLUORESCENCE QUENCHING KINETICS IN MICELLES WITH
PROBE MIGRATION.
Gehlen MH. p 275-279
X-RAY ABSORPTION STUDY OF POTENTIAL BARRIER EFFECT IN GROUP 14
TETRACHLORIDES (GECL4, SNCL4) AND GROUP 15 TRICHLORIDES (PCL3, ASCL3).
Guillot F; Dezarnauddandine C; Tronc M. p 281-300
NEON MATRIX SPECTRA AND ISOTOPICALLY DEPENDENT FLUORESCENCE QUANTUM YIELDS
OF BO2.
Agreiter J; Lorenz M; Smith AM; Bondybey VE. p 301-313
EFFECTIVE STIMULATED EMISSION AND EXCITED-STATE ABSORPTION CROSS-SECTION
SPECTRA OF POLY(M-PHENYLENEVINYLENE-CO-2,5-DIOCTOXY-P-PHENYLENEVINYLEE)
AND T,T'-DIDECYLOXY-II-DISTYRYLBENZENE.
Holzer W; Penzkofer A; Gong SH; Bradley DDC; Long X; Bleyer A.
p 315-326
INFLUENCE OF THE PH ON THE POCKET FIELD OF CYTOCHROME C TYPE PROTEINS.
Kohler M; Friedrich J; Laberge M; Vanderkooi JM. p 327-335