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Results: 1-8 |
Results: 8
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
TRENDS IN GEOMETRIC AND ELECTRONIC-PROPERTIES OF THIOPHENE-BASED AND CYCLOPENTADIENE-BASED POLYMERS
Authors: SUBRAMANIAN H LAGOWSKI JB
Citation: H. Subramanian et Jb. Lagowski, TRENDS IN GEOMETRIC AND ELECTRONIC-PROPERTIES OF THIOPHENE-BASED AND CYCLOPENTADIENE-BASED POLYMERS, International journal of quantum chemistry, 66(3), 1998, pp. 229-240
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
AB-INITIO STUDY OF THE STRUCTURE OF POLY[DI(PHENOXY)THIONYLPHOSPHAZENE]
Authors: LAGOWSKI JB JAEGER R MANNERS I VANCSO GJ
Citation: Jb. Lagowski et al., AB-INITIO STUDY OF THE STRUCTURE OF POLY[DI(PHENOXY)THIONYLPHOSPHAZENE], Journal of molecular structure. Theochem, 339, 1995, pp. 169-177
AB-INITIO STUDIES ON THE STRUCTURE, CONFORMATION, AND CHAIN FLEXIBILITY OF HALOGENATED POLY(THIONYLPHOSPHAZENES)
Authors: JAEGER R LAGOWSKI JB MANNERS I VANCSO GJ
Citation: R. Jaeger et al., AB-INITIO STUDIES ON THE STRUCTURE, CONFORMATION, AND CHAIN FLEXIBILITY OF HALOGENATED POLY(THIONYLPHOSPHAZENES), Macromolecules, 28(2), 1995, pp. 539-546
CONFORMATIONAL STUDY OF HALOGEN-SUBSTITUTED AND HYDROGEN-SUBSTITUTED POLYTHIONYLPHOSPHAZENES USING DENSITY-FUNCTIONAL THEORY METHOD
Authors: RAJA AV LAGOWSKI JB
Citation: Av. Raja et Jb. Lagowski, CONFORMATIONAL STUDY OF HALOGEN-SUBSTITUTED AND HYDROGEN-SUBSTITUTED POLYTHIONYLPHOSPHAZENES USING DENSITY-FUNCTIONAL THEORY METHOD, International journal of quantum chemistry, 54(2), 1995, pp. 117-136
AB-INITIO STUDY OF THE STRUCTURES OF POLYTHIONYLPHOSPHAZENE MOLECULARMIMICS WITH H, CL, AND CH3 SIDE-GROUPS - 3-21G-ASTERISK AND 6-31G-ASTERISK BASIS-SETS COMPARISON
Authors: LAGOWSKI JB JAEGER R
Citation: Jb. Lagowski et R. Jaeger, AB-INITIO STUDY OF THE STRUCTURES OF POLYTHIONYLPHOSPHAZENE MOLECULARMIMICS WITH H, CL, AND CH3 SIDE-GROUPS - 3-21G-ASTERISK AND 6-31G-ASTERISK BASIS-SETS COMPARISON, International journal of quantum chemistry, 53(3), 1995, pp. 321-334
Risultati: 1-8 |