Results: 1-12 |
Results: 12
AB-INITIO MODELING OF THE ENDOHEDRAL REACTIVITY OF POLYOXOMETALATES -2 - ELECTROSTATIC POTENTIAL DISTRIBUTIONS IN ELECTRONICALLY INVERSE HOSTS
Authors: BLAUDEAU JP ROHMER MM BENARD M GHERMANI NE
Citation: Jp. Blaudeau et al., AB-INITIO MODELING OF THE ENDOHEDRAL REACTIVITY OF POLYOXOMETALATES -2 - ELECTROSTATIC POTENTIAL DISTRIBUTIONS IN ELECTRONICALLY INVERSE HOSTS, COMPTES RENDUS DE L ACADEMIE DES SCIENCES SERIE II FASCICULE C-CHIMIE, 1(5-6), 1998, pp. 319-332
ELECTROSTATIC PROPERTIES IN ZEOLITE-TYPE MATERIALS FROM HIGH-RESOLUTION X-RAY-DIFFRACTION - THE CASE OF NATROLITE
Authors: GHERMANI NE LECOMTE C DUSAUSOY Y
Citation: Ne. Ghermani et al., ELECTROSTATIC PROPERTIES IN ZEOLITE-TYPE MATERIALS FROM HIGH-RESOLUTION X-RAY-DIFFRACTION - THE CASE OF NATROLITE, Physical review. B, Condensed matter, 53(9), 1996, pp. 5231-5239
HYDROGEN-BONDS - FIRST QUANTITATIVE AGREEMENT BETWEEN ELECTROSTATIC POTENTIAL CALCULATIONS FROM EXPERIMENTAL X-(X-INITIO SCF MODELS(N) AND THEORETICAL AB)
Authors: ESPINOSA E LECOMTE C GHERMANI NE DEVEMY J ROHMER MM BENARD M MOLINS E
Citation: E. Espinosa et al., HYDROGEN-BONDS - FIRST QUANTITATIVE AGREEMENT BETWEEN ELECTROSTATIC POTENTIAL CALCULATIONS FROM EXPERIMENTAL X-(X-INITIO SCF MODELS(N) AND THEORETICAL AB), Journal of the American Chemical Society, 118(10), 1996, pp. 2501-2502
IODINATION OF ALPHA-PHOSPHINO ENOLATE COMPLEXES OF PALLADIUM(II) AND PLATINUM(II). SYNTHESIS AND CRYSTAL-STRUCTURES OF NTER-DOT-CENTER-DOT-C(CENTER-DOT-CENTER-DOT-O)PH)] AND OF THE DIPALLADIUM(II) COMPLEX TER-DOT-C(CENTER-DOT-CENTER-DOT-O)PH)PD(I)(TMEDA)] OBTAINED BY PALLADIUM(0) INSERTION INTO THE CARBON-IODINE BOND
Authors: ANDRIEU J BRAUNSTEIN P DUSAUSOY Y GHERMANI NE
Citation: J. Andrieu et al., IODINATION OF ALPHA-PHOSPHINO ENOLATE COMPLEXES OF PALLADIUM(II) AND PLATINUM(II). SYNTHESIS AND CRYSTAL-STRUCTURES OF NTER-DOT-CENTER-DOT-C(CENTER-DOT-CENTER-DOT-O)PH)] AND OF THE DIPALLADIUM(II) COMPLEX TER-DOT-C(CENTER-DOT-CENTER-DOT-O)PH)PD(I)(TMEDA)] OBTAINED BY PALLADIUM(0) INSERTION INTO THE CARBON-IODINE BOND, Inorganic chemistry, 35(24), 1996, pp. 7174-7180
LOW-TEMPERATURE ORDERED PHASE OF CAU(PO4)(2) - SYNTHESIS AND CRYSTAL-STRUCTURE
Authors: DUSAUSOY Y GHERMANI NE PODOR R CUNEY M
Citation: Y. Dusausoy et al., LOW-TEMPERATURE ORDERED PHASE OF CAU(PO4)(2) - SYNTHESIS AND CRYSTAL-STRUCTURE, European journal of mineralogy, 8(4), 1996, pp. 667-673
METALLIC COMPLEXATION BY INNER AND OUTER NITROGENS OF BIS(DIAZINE) HETEROCYCLES - THE CASES OF 4,4'-BIPYRIMIDINE AND 2,2'-BIPYRAZINE
Authors: BODARHOUILLON F HUMBERT T MARSURA A DEVAINS JBR DUSAUSOY O BOUHMAIDA N GHERMANI NE DUSAUSOY Y
Citation: F. Bodarhouillon et al., METALLIC COMPLEXATION BY INNER AND OUTER NITROGENS OF BIS(DIAZINE) HETEROCYCLES - THE CASES OF 4,4'-BIPYRIMIDINE AND 2,2'-BIPYRAZINE, Inorganic chemistry, 34(21), 1995, pp. 5205-5209
MODELING ELECTROSTATIC POTENTIAL FROM EXPERIMENTALLY DETERMINED CHARGE-DENSITIES .1. SPHERICAL-ATOM APPROXIMATION
Authors: GHERMANI NE BOUHMAIDA N LECOMTE C
Citation: Ne. Ghermani et al., MODELING ELECTROSTATIC POTENTIAL FROM EXPERIMENTALLY DETERMINED CHARGE-DENSITIES .1. SPHERICAL-ATOM APPROXIMATION, Acta crystallographica. Section A, Foundations of crystallography, 49, 1993, pp. 781-789
MODELING ELECTROSTATIC POTENTIAL FROM EXPERIMENTALLY DETERMINED CHARGE-DENSITIES .2. TOTAL POTENTIAL
Authors: BOUHMAIDA N GHERMANI NE LECOMTE C THALAL A
Citation: N. Bouhmaida et al., MODELING ELECTROSTATIC POTENTIAL FROM EXPERIMENTALLY DETERMINED CHARGE-DENSITIES .2. TOTAL POTENTIAL, Acta crystallographica. Section A, Foundations of crystallography, 53, 1997, pp. 556-563
NON-CENTROSYMMETRICAL MATERIALS WITH A 2'-METHYL-6,6'-DIPHENYL-4,4'-BIPYRIMIDINE SUBUNIT AND DIFFERENT 2-BRANCHED CHAINS - SYNTHESIS, CHARACTERIZATION AND X-RAY STRUCTURE
Authors: HUMBERT T MARSURA A BOUHMAIDA N GHERMANI NE
Citation: T. Humbert et al., NON-CENTROSYMMETRICAL MATERIALS WITH A 2'-METHYL-6,6'-DIPHENYL-4,4'-BIPYRIMIDINE SUBUNIT AND DIFFERENT 2-BRANCHED CHAINS - SYNTHESIS, CHARACTERIZATION AND X-RAY STRUCTURE, New journal of chemistry, 21(4), 1997, pp. 503-510
STRUCTURE AND PRELIMINARY ELECTRON-DISTRIBUTION OF COPPER HEPTANOATE FROM ROOM-TEMPERATURE X-RAY DATA
Authors: GHERMANI NE LECOMTE C RAPIN C STEINMETZ P STEINMETZ J MALAMAN B
Citation: Ne. Ghermani et al., STRUCTURE AND PRELIMINARY ELECTRON-DISTRIBUTION OF COPPER HEPTANOATE FROM ROOM-TEMPERATURE X-RAY DATA, Acta crystallographica. Section B, Structural science, 50, 1994, pp. 157-160
SYNTHESIS, THEORETICAL CONFORMATIONAL STUDY AND X-RAY STRUCTURES OF 2,2'-DIMETHYL-4,4'-BIPYRIMIDINE AND 6,6'-DIMETHYL-2,2'-BIPYRAZINE
Authors: DEVAINS JBR LEHN JM GHERMANI NE DUSAUSOY O DUSAUSOY Y PAPET AL MARSURA A FRIANT P RIVAIL JL
Citation: Jbr. Devains et al., SYNTHESIS, THEORETICAL CONFORMATIONAL STUDY AND X-RAY STRUCTURES OF 2,2'-DIMETHYL-4,4'-BIPYRIMIDINE AND 6,6'-DIMETHYL-2,2'-BIPYRAZINE, New journal of chemistry, 18(6), 1994, pp. 701-708
USE OF THE EXPERIMENTAL ELECTROSTATIC POTENTIAL TO PREDICT THE COMPLEXATION OF METALLIC ATOMS - THE CASE OF BIPYRIMIDINE LIGANDS
Authors: GHERMANI NE BOUHMAIDA N LECOMTE C PAPET AL MARSURA A
Citation: Ne. Ghermani et al., USE OF THE EXPERIMENTAL ELECTROSTATIC POTENTIAL TO PREDICT THE COMPLEXATION OF METALLIC ATOMS - THE CASE OF BIPYRIMIDINE LIGANDS, Journal of physical chemistry, 98(25), 1994, pp. 6287-6292
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