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Results: 1-10 |
Results: 10
ADSORPTION OF WATER ON ZEOLITES OF DIFFERENT TYPES
Authors: HUNGER B MATYSIK S HEUCHEL M GEIDEL E TOUFAR H
Citation: B. Hunger et al., ADSORPTION OF WATER ON ZEOLITES OF DIFFERENT TYPES, Journal of thermal analysis, 49(1), 1997, pp. 553-565
SHELL STRUCTURE OF ATOMS
Authors: SEN KD GAYATRI TV TOUFAR H
Citation: Kd. Sen et al., SHELL STRUCTURE OF ATOMS, Journal of molecular structure. Theochem, 361, 1996, pp. 1-13
DEPENDENCE OF THE HARDNESS OF ATOMS IN MOLECULES ON THE LOCAL ENVIRONMENT - AN AB-INITIO STUDY
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
ANALYSIS OF THE ZEOLITE-CATALYZED H-EXCHANGE REACTION OF METHANE USING ATOM-IN-MOLECULE REACTIVITY INDEXES
Authors: JANSSENS GOA TOUFAR H BAEKELANDT BG MORTIER WJ SCHOONHEYDT RA
Citation: Goa. Janssens et al., ANALYSIS OF THE ZEOLITE-CATALYZED H-EXCHANGE REACTION OF METHANE USING ATOM-IN-MOLECULE REACTIVITY INDEXES, Journal of physical chemistry, 100(34), 1996, pp. 14443-14450
A SIMPLE-MODEL FOR THE KINETIC EVALUATION OF ZEOLITE CRYSTALLIZATION PROCESSES
Authors: TOUFAR H WENDLANDT KP KARGE HG
Citation: H. Toufar et al., A SIMPLE-MODEL FOR THE KINETIC EVALUATION OF ZEOLITE CRYSTALLIZATION PROCESSES, Journal of the Chemical Society. Faraday transactions, 91(3), 1995, pp. 549-554
INVESTIGATION OF SUPRAMOLECULAR SYSTEMS BY A COMBINATION OF THE ELECTRONEGATIVITY EQUALIZATION METHOD AND A MONTE-CARLO SIMULATION TECHNIQUE
Authors: TOUFAR H BAEKELANDT BG JANSSENS GOA MORTIER WJ SCHOONHEYDT RA
Citation: H. Toufar et al., INVESTIGATION OF SUPRAMOLECULAR SYSTEMS BY A COMBINATION OF THE ELECTRONEGATIVITY EQUALIZATION METHOD AND A MONTE-CARLO SIMULATION TECHNIQUE, Journal of physical chemistry, 99(38), 1995, pp. 13876-13885
MAPPING BETWEEN ELECTRON POPULATION AND VIBRATIONAL NORMAL-MODES WITHIN THE CHARGE SENSITIVITY ANALYSIS
Authors: BAEKELANDT BG JANSSENS GOA TOUFAR H MORTIER WJ SCHOONHEYDT RA NALEWAJSKI RF
Citation: Bg. Baekelandt et al., MAPPING BETWEEN ELECTRON POPULATION AND VIBRATIONAL NORMAL-MODES WITHIN THE CHARGE SENSITIVITY ANALYSIS, Journal of physical chemistry, 99(24), 1995, pp. 9784-9794
COMPARISON OF CLUSTER AND INFINITE CRYSTAL CALCULATIONS ON ZEOLITES WITH THE ELECTRONEGATIVITY EQUALIZATION METHOD (EEM)
Authors: JANSSENS GOA BAEKELANDT BG TOUFAR H MORTIER WJ SCHOONHEYDT RA
Citation: Goa. Janssens et al., COMPARISON OF CLUSTER AND INFINITE CRYSTAL CALCULATIONS ON ZEOLITES WITH THE ELECTRONEGATIVITY EQUALIZATION METHOD (EEM), Journal of physical chemistry, 99(10), 1995, pp. 3251-3258
ON THE RELATION BETWEEN ELECTRONIC AND NUCLEAR VIBRATIONS VIA THE RESPONSE MATRIX DERIVED FROM SEMIEMPIRICAL DENSITY FUNCTIONAL-BASED SENSITIVITY ANALYSIS
Authors: JANSSENS GOA BAEKELANDT BG TOUFAR H MORTIER WJ SCHOONHEYDT RA
Citation: Goa. Janssens et al., ON THE RELATION BETWEEN ELECTRONIC AND NUCLEAR VIBRATIONS VIA THE RESPONSE MATRIX DERIVED FROM SEMIEMPIRICAL DENSITY FUNCTIONAL-BASED SENSITIVITY ANALYSIS, International journal of quantum chemistry, 56(4), 1995, pp. 317-326
AVERAGE LOCAL ELECTROSTATIC POTENTIAL AND THE CORE-VALENCY SEPARATIONIN ATOMS
Authors: SEN KD GAYATRI TV KRISHNAVENI R KAKKAR M TOUFAR H JANSSENS GOA BAEKELANDT BG SCHOONHEYDT RA MORTIER WJ
Citation: Kd. Sen et al., AVERAGE LOCAL ELECTROSTATIC POTENTIAL AND THE CORE-VALENCY SEPARATIONIN ATOMS, International journal of quantum chemistry, 56(4), 1995, pp. 399-408
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