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Results: 1-14 |
Results: 14
THE STRUCTURE AND ENERGETICS OF GLYCINE POLYMORPHS BASED ON FIRST PRINCIPLES SIMULATION USING DENSITY-FUNCTIONAL THEORY
Authors: FREEMAN CM ANDZELM JW EWIG CS HILL JR DELLEY B
Citation: Cm. Freeman et al., THE STRUCTURE AND ENERGETICS OF GLYCINE POLYMORPHS BASED ON FIRST PRINCIPLES SIMULATION USING DENSITY-FUNCTIONAL THEORY, Chemical communications, (22), 1998, pp. 2455-2456
ACCELERATED APPROACH TO NONFRAMEWORK CATION PLACEMENT IN CRYSTALLINE MATERIALS
Authors: GORMAN AM FREEMAN CM KOLMEL CM NEWSAM JM
Citation: Am. Gorman et al., ACCELERATED APPROACH TO NONFRAMEWORK CATION PLACEMENT IN CRYSTALLINE MATERIALS, Faraday discussions, (106), 1997, pp. 489-494
SIMULATING NONFRAMEWORK CATION LOCATION IN ALUMINOSILICATE ZEOLITES
Authors: NEWSAM JM FREEMAN CM GORMAN AM VESSAL B
Citation: Jm. Newsam et al., SIMULATING NONFRAMEWORK CATION LOCATION IN ALUMINOSILICATE ZEOLITES, Chemical communications, (16), 1996, pp. 1945-1946
AB-INITIO AND MOLECULAR-MECHANICS STUDIES OF ALUMINOSILICATE FRAGMENTS, AND THE ORIGIN OF LOWENSTEINS RULE
Authors: CATLOW CRA GEORGE AR FREEMAN CM
Citation: Cra. Catlow et al., AB-INITIO AND MOLECULAR-MECHANICS STUDIES OF ALUMINOSILICATE FRAGMENTS, AND THE ORIGIN OF LOWENSTEINS RULE, Chemical communications, (11), 1996, pp. 1311-1312
PREDICTION OF TEMPLATE LOCATION VIA A COMBINED MONTE CARLO-SIMULATED ANNEALING APPROACH
Authors: STEVENS AP GORMAN AH FREEMAN CM COX PA
Citation: Ap. Stevens et al., PREDICTION OF TEMPLATE LOCATION VIA A COMBINED MONTE CARLO-SIMULATED ANNEALING APPROACH, Journal of the Chemical Society. Faraday transactions, 92(12), 1996, pp. 2065-2073
A COMPUTATIONAL INVESTIGATION OF ZEOLITE-CHLOROFLUOROCARBON INTERACTIONS
Authors: GEORGE AR FREEMAN CM CATLOW CRA
Citation: Ar. George et al., A COMPUTATIONAL INVESTIGATION OF ZEOLITE-CHLOROFLUOROCARBON INTERACTIONS, Zeolites, 17(5-6), 1996, pp. 466-472
MOLECULAR MECHANICS STUDY OF OLIGOMERIC MODELS FOR POLY(FERROCENYLSILANES) USING THE EXTENSIBLE SYSTEMATIC FORCEFIELD (ESFF)
Authors: BARLOW S ROHL AL SHI SG FREEMAN CM OHARE D
Citation: S. Barlow et al., MOLECULAR MECHANICS STUDY OF OLIGOMERIC MODELS FOR POLY(FERROCENYLSILANES) USING THE EXTENSIBLE SYSTEMATIC FORCEFIELD (ESFF), Journal of the American Chemical Society, 118(32), 1996, pp. 7578-7592
PREDICTING THE TEMPLATING ABILITY OF ORGANIC ADDITIVES FOR THE SYNTHESIS OF MICROPOROUS MATERIALS
Authors: LEWIS DW FREEMAN CM CATLOW CRA
Citation: Dw. Lewis et al., PREDICTING THE TEMPLATING ABILITY OF ORGANIC ADDITIVES FOR THE SYNTHESIS OF MICROPOROUS MATERIALS, Journal of physical chemistry, 99(28), 1995, pp. 11194-11202
AVERSIVE EXCHANGES WITH PEERS AND ADJUSTMENT DURING EARLY ADOLESCENCE- IS DISCLOSURE HELPFUL
Authors: VERNBERG EM EWELL KK BEERY SH FREEMAN CM ABWENDER DA
Citation: Em. Vernberg et al., AVERSIVE EXCHANGES WITH PEERS AND ADJUSTMENT DURING EARLY ADOLESCENCE- IS DISCLOSURE HELPFUL, Child psychiatry and human development, 26(1), 1995, pp. 43-59
QUANTUM AND MOLECULAR MECHANICS STUDY OF THE TRIS(QUATERNARY AMMONIUM) CATION USED AS THE ZEOLITE ZSM-18 SYNTHESIS TEMPLATE
Authors: KOELMEL CM LI YS FREEMAN CM LEVINE SM HWANG MJ MAPLE JR NEWSAM JM
Citation: Cm. Koelmel et al., QUANTUM AND MOLECULAR MECHANICS STUDY OF THE TRIS(QUATERNARY AMMONIUM) CATION USED AS THE ZEOLITE ZSM-18 SYNTHESIS TEMPLATE, Journal of physical chemistry, 98(49), 1994, pp. 12911-12918
COMPUTER-ASSISTED SCREENING OF ZEOLITE CATALYSTS FOR THE SELECTIVE ISOPROPYLATION OF NAPHTHALENE
Authors: HORSLEY JA FELLMANN JD DEROUANE EG FREEMAN CM
Citation: Ja. Horsley et al., COMPUTER-ASSISTED SCREENING OF ZEOLITE CATALYSTS FOR THE SELECTIVE ISOPROPYLATION OF NAPHTHALENE, Journal of catalysis, 147(1), 1994, pp. 231-240
SIMULATING AND PREDICTING CRYSTAL-STRUCTURES
Authors: CATLOW CRA THOMAS JM FREEMAN CM WRIGHT PA BELL RG
Citation: Cra. Catlow et al., SIMULATING AND PREDICTING CRYSTAL-STRUCTURES, Proceedings - Royal Society. Mathematical and physical sciences, 442(1914), 1993, pp. 85
INORGANIC CRYSTAL-STRUCTURE PREDICTION USING SIMPLIFIED POTENTIALS AND EXPERIMENTAL UNIT CELLS - APPLICATION TO THE POLYMORPHS OF TITANIUM-DIOXIDE
Authors: FREEMAN CM NEWSAM JM LEVINE SM CATLOW CRA
Citation: Cm. Freeman et al., INORGANIC CRYSTAL-STRUCTURE PREDICTION USING SIMPLIFIED POTENTIALS AND EXPERIMENTAL UNIT CELLS - APPLICATION TO THE POLYMORPHS OF TITANIUM-DIOXIDE, Journal of materials chemistry, 3(5), 1993, pp. 531-535
LOST HYDROGEN-BONDS AND BURIED SURFACE-AREA - RATIONALIZING STABILITYIN GLOBULAR-PROTEINS
Authors: SAVAGE HJ ELLIOTT CJ FREEMAN CM FINNEY JL
Citation: Hj. Savage et al., LOST HYDROGEN-BONDS AND BURIED SURFACE-AREA - RATIONALIZING STABILITYIN GLOBULAR-PROTEINS, Journal of the Chemical Society. Faraday transactions, 89(15), 1993, pp. 2609-2617
Risultati: 1-14 |