AAAAAA

   
Results: 1-20 |
Results: 20
ACCURATE METHOD FOR OBTAINING BAND-GAPS IN CONDUCTING POLYMERS USING A DFT HYBRID APPROACH/
Authors: SALZNER U PICKUP PG POIRIER RA LAGOWSKI JB
Citation: U. Salzner et al., ACCURATE METHOD FOR OBTAINING BAND-GAPS IN CONDUCTING POLYMERS USING A DFT HYBRID APPROACH/, The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 102(15), 1998, pp. 2572-2578
COMPARISON OF GEOMETRIES AND ELECTRONIC-STRUCTURES OF POLYACETYLENE, POLYBOROLE, POLYCYCLOPENTADIENE, POLYPYRROLE, POLYFURAN, POLYSILOLE, POLYPHOSPHOLE, POLYTHIOPHENE, POLYSELENOPHENE AND POLYTELLUROPHENE
Authors: SALZNER U LAGOWSKI JB PICKUP PG POIRIER RA
Citation: U. Salzner et al., COMPARISON OF GEOMETRIES AND ELECTRONIC-STRUCTURES OF POLYACETYLENE, POLYBOROLE, POLYCYCLOPENTADIENE, POLYPYRROLE, POLYFURAN, POLYSILOLE, POLYPHOSPHOLE, POLYTHIOPHENE, POLYSELENOPHENE AND POLYTELLUROPHENE, Synthetic metals, 96(3), 1998, pp. 177-189
GRAPHICAL APPROACH FOR DEFINING NATURAL INTERNAL COORDINATES
Authors: PYE CC POIRIER RA
Citation: Cc. Pye et Ra. Poirier, GRAPHICAL APPROACH FOR DEFINING NATURAL INTERNAL COORDINATES, Journal of computational chemistry, 19(5), 1998, pp. 504-511
AN AB-INITIO STUDY OF FACIAL SELECTIVITY IN THE DIELS-ALDER REACTION
Authors: XIDOS JD POIRIER RA PYE CC BURNELL DJ
Citation: Jd. Xidos et al., AN AB-INITIO STUDY OF FACIAL SELECTIVITY IN THE DIELS-ALDER REACTION, Journal of organic chemistry, 63(1), 1998, pp. 105-112
GENERALIZED VALENCE-BOND STUDY OF ROTATIONAL SINGLET STRUCTURES AND PI-BOND-ENERGIES FOR SYSTEMS CONTAINING C=C, SI=SI, AND C=SI DOUBLE BONDS
Authors: WANG YL POIRIER RA
Citation: Yl. Wang et Ra. Poirier, GENERALIZED VALENCE-BOND STUDY OF ROTATIONAL SINGLET STRUCTURES AND PI-BOND-ENERGIES FOR SYSTEMS CONTAINING C=C, SI=SI, AND C=SI DOUBLE BONDS, Canadian journal of chemistry, 76(4), 1998, pp. 477-482
FACTORS THAT INFLUENCE THE C=N STRETCHING FREQUENCY IN IMINES
Authors: WANG YL POIRIER RA
Citation: Yl. Wang et Ra. Poirier, FACTORS THAT INFLUENCE THE C=N STRETCHING FREQUENCY IN IMINES, The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 101(5), 1997, pp. 907-912
EXAMINATION OF THE VALENCE TAUTOMERS BENZENE OXIDE AND OXEPIN AND 2 DERIVATIVE SYSTEMS BY AB-INITIO METHODS
Authors: PYE CC XIDOS JD POIRIER RA BURNELL DJ
Citation: Cc. Pye et al., EXAMINATION OF THE VALENCE TAUTOMERS BENZENE OXIDE AND OXEPIN AND 2 DERIVATIVE SYSTEMS BY AB-INITIO METHODS, The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 101(18), 1997, pp. 3371-3376
DESIGN OF LOW-BAND-GAP POLYMERS EMPLOYING DENSITY-FUNCTIONAL THEORY -HYBRID FUNCTIONALS AMELIORATE BAND-GAP PROBLEM
Authors: SALZNER U LAGOWSKI JB PICKUP PG POIRIER RA
Citation: U. Salzner et al., DESIGN OF LOW-BAND-GAP POLYMERS EMPLOYING DENSITY-FUNCTIONAL THEORY -HYBRID FUNCTIONALS AMELIORATE BAND-GAP PROBLEM, Journal of computational chemistry, 18(15), 1997, pp. 1943-1953
POLITICAL RISK ANALYSIS AND TOURISM
Authors: POIRIER RA
Citation: Ra. Poirier, POLITICAL RISK ANALYSIS AND TOURISM, Annals of tourism research, 24(3), 1997, pp. 675-686
COMPUTATIONAL DEVELOPMENTS IN GENERALIZED VALENCE-BOND CALCULATIONS
Authors: WANG YL POIRIER RA
Citation: Yl. Wang et Ra. Poirier, COMPUTATIONAL DEVELOPMENTS IN GENERALIZED VALENCE-BOND CALCULATIONS, Journal of computational chemistry, 17(3), 1996, pp. 313-325
AN AB-INITIO INVESTIGATION OF LITHIUM ION HYDRATION
Authors: PYE CC RUDOLPH W POIRIER RA
Citation: Cc. Pye et al., AN AB-INITIO INVESTIGATION OF LITHIUM ION HYDRATION, Journal of physical chemistry, 100(2), 1996, pp. 601-605
GENERALIZED VALENCE-BOND MOLECULAR EQUILIBRIUM GEOMETRIES
Authors: WANG YL POIRIER RA
Citation: Yl. Wang et Ra. Poirier, GENERALIZED VALENCE-BOND MOLECULAR EQUILIBRIUM GEOMETRIES, Journal of molecular structure. Theochem, 340, 1995, pp. 1-14
TOURISM AND DEVELOPMENT IN TUNISIA
Authors: POIRIER RA
Citation: Ra. Poirier, TOURISM AND DEVELOPMENT IN TUNISIA, Annals of tourism research, 22(1), 1995, pp. 157-171
ORIGIN OF FACIAL SELECTIVITY IN THE DIELS-ALDER REACTIONS OF 5-SUBSTITUTED 1,3-CYCLOPENTADIENES
Authors: POIRIER RA PYE CC XIDOS JD BURNELL DJ
Citation: Ra. Poirier et al., ORIGIN OF FACIAL SELECTIVITY IN THE DIELS-ALDER REACTIONS OF 5-SUBSTITUTED 1,3-CYCLOPENTADIENES, Journal of organic chemistry, 60(8), 1995, pp. 2328-2329
AB-INITIO HARTREE-FOCK CALCULATIONS OF THE INTERACTION ENERGY OF BIOMOLECULAR COMPLEXES
Authors: PYE CC POIRIER RA YU D SURJAN PR
Citation: Cc. Pye et al., AB-INITIO HARTREE-FOCK CALCULATIONS OF THE INTERACTION ENERGY OF BIOMOLECULAR COMPLEXES, Journal of molecular structure. Theochem, 113, 1994, pp. 239-259
OSIPE - A TOOL FOR SCIENTIFIC PROGRAMMING IN FORTRAN
Authors: COLONNA F JOLLY LH POIRIER RA ANGYAN JG JANSEN G
Citation: F. Colonna et al., OSIPE - A TOOL FOR SCIENTIFIC PROGRAMMING IN FORTRAN, Computer physics communications, 81(3), 1994, pp. 293-317
AB-INITIO STUDY OF C-H BOND BREAKING IN OLEFINS .2. GVB COMPUTATIONS ON PROPENE[--]H PLUS CIS-PROPEN-1-YL OR TRANS-PROPEN-1-YL
Authors: DEMARE GR EVLETH EM POIRIER RA COLLIN GJ
Citation: Gr. Demare et al., AB-INITIO STUDY OF C-H BOND BREAKING IN OLEFINS .2. GVB COMPUTATIONS ON PROPENE[--]H PLUS CIS-PROPEN-1-YL OR TRANS-PROPEN-1-YL, Canadian journal of chemistry, 72(5), 1994, pp. 1230-1237
AB-INITIO STUDY ON THE THERMAL DECARBOXYLATION OF BUT-3-ENOIC ACID AND ITS DERIVATIVES
Authors: WANG YL POIRIER RA
Citation: Yl. Wang et Ra. Poirier, AB-INITIO STUDY ON THE THERMAL DECARBOXYLATION OF BUT-3-ENOIC ACID AND ITS DERIVATIVES, Canadian journal of chemistry, 72(5), 1994, pp. 1338-1346
A THEORETICAL-STUDY OF THE RELATIONSHIP BETWEEN SECONDARY ALPHA-DEUTERIUM KINETIC ISOTOPE EFFECTS AND THE STRUCTURE OF S(N)2 TRANSITION-STATES
Authors: POIRIER RA WANG YL WESTAWAY KC
Citation: Ra. Poirier et al., A THEORETICAL-STUDY OF THE RELATIONSHIP BETWEEN SECONDARY ALPHA-DEUTERIUM KINETIC ISOTOPE EFFECTS AND THE STRUCTURE OF S(N)2 TRANSITION-STATES, Journal of the American Chemical Society, 116(6), 1994, pp. 2526-2533
THE POLITICAL-ECONOMY OF TOURISM IN TUNISIA
Authors: POIRIER RA WRIGHT S
Citation: Ra. Poirier et S. Wright, THE POLITICAL-ECONOMY OF TOURISM IN TUNISIA, Journal of modern African studies, 31(1), 1993, pp. 149-162
Risultati: 1-20 |