AAAAAA
Results: 26-50/55
Authors:
VERBANDT Y
THIENPONT H
VERETENNICOFF I
GEERLINGS P
RIKKEN GLJA
Citation: Y. Verbandt et al., ORIGIN OF THE SATURATION OF THE 3RD-ORDER OPTICAL NONLINEAR RESPONSE OF ONE-DIMENSIONAL CONJUGATED SYSTEMS, Chemical physics letters, 270(5-6), 1997, pp. 471-475
Authors:
ROTHE H
HARTMANN B
GEERLINGS P
KOLB H
Citation: H. Rothe et al., NITRIC-OXIDE REGULATES INTERLEUKIN-12 EXPRESSION IN MACROPHAGES, Journal of leukocyte biology, 1996, pp. 38-38
Authors:
CHOHO K
VANLIER G
VANDEWOUDE G
GEERLINGS P
Citation: K. Choho et al., ACIDITY OF HYDROFULLERENES - A QUANTUM-CHEMICAL STUDY, Perkin transactions. 2, (8), 1996, pp. 1723-1732
Authors:
BIESEMANS M
WILLEM R
DAMOUN S
GEERLINGS P
LAHCINI M
JAUMIER P
JOUSSEAUME B
Citation: M. Biesemans et al., COORDINATION BEHAVIOR OF OMEGA-(TRICHLOROSTANNYL)ALKYL ACETATES, CH3COO(CH2)(N)SNCL3 (N=3-5) - A SOLUTION AND SOLID-STATE MULTINUCLEAR NMR AND AM1 QUANTUM-CHEMICAL STUDY, Organometallics, 15(9), 1996, pp. 2237-2245
Authors:
CHOHO K
LANGENAEKER W
VANDEWOUDE G
GEERLINGS P
Citation: K. Choho et al., LOCAL SOFTNESS AND HARDNESS AS REACTIVITY INDEXES IN THE FULLERENES C-24-C-76, Journal of molecular structure. Theochem, 362(3), 1996, pp. 305-315
Authors:
LANGENAEKER W
DEPROFT F
GEERLINGS P
Citation: W. Langenaeker et al., ELECTRON CORRELATION-EFFECTS ON FUKUI FUNCTIONS, Journal of molecular structure. Theochem, 362(2), 1996, pp. 175-179
Authors:
VANFAASSEN A
VANDENBOGAARD AE
HAZEN MJ
GEERLINGS P
HERMUS RJJ
JANKNEGT RA
Citation: A. Vanfaassen et al., EFFECTS OF CALCISORB ON FECAL BILE-ACIDS AND FATTY-ACIDS IN HUMAN VOLUNTEERS, Digestive diseases and sciences, 41(12), 1996, pp. 2319-2325
Authors:
TOUFAR H
NULENS K
JANSSENS GOA
MORTIER WJ
SCHOONHEYDT RA
DEPROFT F
GEERLINGS P
Citation: H. Toufar et al., DEPENDENCE OF THE HARDNESS OF ATOMS IN MOLECULES ON THE LOCAL ENVIRONMENT - AN AB-INITIO STUDY, Journal of physical chemistry, 100(38), 1996, pp. 15383-15387
Authors:
DEPROFT F
VANALSENOY C
GEERLINGS P
Citation: F. Deproft et al., AB-INITIO STUDY OF THE ENDOHEDRAL COMPLEXES OF C-60, SI-60, AND GE-60WITH MONOATOMIC IONS - INFLUENCE OF ELECTROSTATIC EFFECTS AND HARDNESS, Journal of physical chemistry, 100(18), 1996, pp. 7440-7448
Authors:
BAETEN A
DEPROFT F
GEERLINGS P
Citation: A. Baeten et al., PROTON AFFINITY OF AMINO-ACIDS - THEIR INTERPRETATION WITH DENSITY-FUNCTIONAL THEORY-BASED DESCRIPTORS, International journal of quantum chemistry, 60(4), 1996, pp. 931-939
Authors:
DEPROFT F
GEERLINGS P
Citation: F. Deproft et P. Geerlings, AB-INITIO AND DENSITY-FUNCTIONAL STUDY OF THE JAHN-TELLER DISTORTION IN THE SILANE RADICAL-CATION, Chemical physics letters, 262(6), 1996, pp. 782-788
Authors:
DEPROFT F
MARTIN JML
GEERLINGS P
Citation: F. Deproft et al., CALCULATION OF MOLECULAR ELECTROSTATIC POTENTIALS AND FUKUI FUNCTIONSUSING DENSITY-FUNCTIONAL METHODS, Chemical physics letters, 256(4-5), 1996, pp. 400-408
Authors:
VERBANDT Y
THIENPONT H
VERETENNICOFF I
GEERLINGS P
Citation: Y. Verbandt et al., OPTICAL-PROPERTIES OF PYRROLE OLIGOMERS - A COUPLED QUANTUM OSCILLATOR APPROACH, Chemical physics letters, 251(1-2), 1996, pp. 47-51
Authors:
DEPROFT F
MARTIN JML
GEERLINGS P
Citation: F. Deproft et al., ON THE PERFORMANCE OF DENSITY-FUNCTIONAL METHODS FOR DESCRIBING ATOMIC POPULATIONS, DIPOLE-MOMENTS AND INFRARED INTENSITIES, Chemical physics letters, 250(3-4), 1996, pp. 393-401
Authors:
ROTHE H
HARTMANN B
GEERLINGS P
KOLB H
Citation: H. Rothe et al., INTERLEUKIN-12 GENE-EXPRESSION OF MACROPHAGES IS REGULATED BY NITRIC-OXIDE, Biochemical and biophysical research communications, 224(1), 1996, pp. 159-163
Authors:
TIJSKENS E
VIAENE WA
GEERLINGS P
Citation: E. Tijskens et al., THE IONIC MODEL - EXTENSION TO SPATIAL CHARGE-DISTRIBUTIONS, DERIVATION OF AN INTERACTION POTENTIAL FOR SILICA POLYMORPHS, Physics and chemistry of minerals, 22(3), 1995, pp. 186-199
Authors:
DEPROFT F
LANGENAEKER W
GEERLINGS P
Citation: F. Deproft et al., A NONEMPIRICAL ELECTRONEGATIVITY EQUALIZATION SCHEME - THEORY AND APPLICATIONS USING ISOLATED ATOM PROPERTIES, Journal of molecular structure. Theochem, 339, 1995, pp. 45-55
Authors:
CHOHO K
LANGENAEKER W
VANDEWOUDE G
GEERLINGS P
Citation: K. Choho et al., REACTIVITY OF FULLERENES - QUANTUM-CHEMICAL DESCRIPTORS VERSUS CURVATURE, Journal of molecular structure. Theochem, 338, 1995, pp. 293-301
Authors:
DEPROFT F
LANGENAEKER W
GEERLINGS P
Citation: F. Deproft et al., ACIDITY OF ALKYL SUBSTITUTED ALCOHOLS - ARE ALKYL-GROUPS ELECTRON-DONATING OR ELECTRON-WITHDRAWING, Tetrahedron, 51(14), 1995, pp. 4021-4032
Authors:
DAMOUN S
LANGENAEKER W
VANDEWOUDE G
GEERLINGS P
Citation: S. Damoun et al., ACIDITY OF HALOGENATED ALCOHOLS AND SILANOLS - COMPETITION OF ELECTRONEGATIVITY AND SOFTNESS IN 2ND AND HIGHER ROW ATOMS, Journal of physical chemistry, 99(32), 1995, pp. 12151-12157
Authors:
LANGENAEKER W
DEPROFT F
GEERLINGS P
Citation: W. Langenaeker et al., DEVELOPMENT OF LOCAL HARDNESS RELATED REACTIVITY INDEXES - THEIR APPLICATION IN A STUDY OF THE SE AT MONOSUBSTITUTED BENZENES WITHIN THE HSAB CONTEXT, Journal of physical chemistry, 99(17), 1995, pp. 6424-6431
Authors:
DEPROFT F
LANGENAEKER W
GEERLINGS P
Citation: F. Deproft et al., ACIDITY OF FIRST-ROW AND SECOND-ROW HYDRIDES - EFFECTS OF ELECTRONEGATIVITY AND HARDNESS, International journal of quantum chemistry, 55(6), 1995, pp. 459-468
Authors:
DEPROFT F
SEN KD
GEERLINGS P
Citation: F. Deproft et al., EFFECTS OF FINITE BASIS-SET EXPANSION AND ELECTRON CORRELATION ON THEATOMIC SHELL STRUCTURE FROM AVERAGE LOCAL ELECTROSTATIC POTENTIAL FUNCTIONS, Chemical physics letters, 247(1-2), 1995, pp. 154-158
Authors:
BAETEN A
DEPROFT F
GEERLINGS P
Citation: A. Baeten et al., BASICITY OF PRIMARY AMINES - A GROUP PROPERTIES BASED STUDY OF THE IMPORTANCE OF INDUCTIVE (ELECTRONEGATIVITY AND SOFTNESS) AND RESONANCE EFFECTS, Chemical physics letters, 235(1-2), 1995, pp. 17-21
Authors:
TIJSKENS E
VIAENE WA
GEERLINGS P
Citation: E. Tijskens et al., THE IONIC MODEL - EXTENSION TO SPATIAL CHARGE-DISTRIBUTIONS, Physics and chemistry of minerals, 20(8), 1994, pp. 601-616