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Results:
1-20
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Results: 20
Authors:
FALANA OM
KOCH HF
ROUNDHILL DM
LUMETTA GJ
HAY BP
Citation: Om. Falana et al., SYNTHESIS AND EXTRACTION STUDIES OF 1,2-DISUBSTITUTED AND 1,3-DISUBSTITUTED BUTYLCALIX[4]ARENE AMIDES WITH OXYIONS - GEOMETRIC AND CONFORMATIONAL EFFECTS, Chemical communications, (4), 1998, pp. 503-504
Authors:
PAULSEN MD
HAY BP
Citation: Md. Paulsen et Bp. Hay, CONFORMATIONAL-ANALYSIS OF CROWN-ETHERS - PART 3 - ALKALI AND ALKALINE-EARTH CATION COMPLEXES OF 15-CROWN-5, Journal of molecular structure. Theochem, 429, 1998, pp. 49-59
Authors:
HAY BP
YANG LR
LII JH
ALLINGER NL
Citation: Bp. Hay et al., AN EXTENDED MM3(96) FORCE-FIELD FOR COMPLEXES OF THE GROUP 1A AND 2A CATIONS WITH LIGANDS BEARING CONJUGATED ETHER DONOR GROUPS, Journal of molecular structure. Theochem, 428, 1998, pp. 203-219
Authors:
HAY BP
CLEMENT O
SANDRONE G
DIXON DA
Citation: Bp. Hay et al., A MOLECULAR MECHANICS (MM3(96)) FORCE-FIELD FOR METAL-AMIDE COMPLEXES, Inorganic chemistry, 37(22), 1998, pp. 5887-5894
Authors:
BRYAN JC
SACHLEBEN RA
LAVIS JM
DAVIS MC
BURNS JH
HAY BP
Citation: Jc. Bryan et al., STRUCTURAL ASPECTS OF RUBIDIUM ION SELECTIVITY BY TRIBENZO-21-CROWN-7, Inorganic chemistry, 37(11), 1998, pp. 2749-2755
Authors:
CLEMENT O
RAPKO BM
HAY BP
Citation: O. Clement et al., STRUCTURAL ASPECTS OF METAL-AMIDE COMPLEXES, Coordination chemistry reviews, 170, 1998, pp. 203-243
Authors:
HAY BP
YANG LR
ZHANG DL
RUSTAD JR
WASSERMAN E
Citation: Bp. Hay et al., AN EXTENDED MOLECULAR MECHANICS (MM3(96)) FORCE-FIELD FOR BENZOCROWN ETHERS, CALIXARENES, AND SPHERANDS, Journal of molecular structure. Theochem, 417(1-2), 1997, pp. 19-34
Authors:
PAULSEN MD
RUSTAD JR
HAY BP
Citation: Md. Paulsen et al., CONFORMATIONAL-ANALYSIS OF CROWN-ETHERS .2. 15-CROWN-5, Journal of molecular structure. Theochem, 397, 1997, pp. 1-12
Authors:
WASSERMAN E
RUSTAD JR
FELMY AR
HAY BP
HALLEY JW
Citation: E. Wasserman et al., EWALD METHODS FOR POLARIZABLE SURFACES WITH APPLICATION TO HYDROXYLATION AND HYDROGEN-BONDING ON THE (012)SURFACE AND (001)SURFACE OF ALPHA-FE2O3, Surface science, 385(2-3), 1997, pp. 217-239
Authors:
HAY BP
RUSTAD JR
Citation: Bp. Hay et Jr. Rustad, WHY THE ADDITION OF NEUTRAL OXYGEN DONOR GROUPS PROMOTES SELECTIVITY FOR LARGER METAL-IONS, Supramolecular chemistry, 6(3-4), 1996, pp. 383-390
Authors:
HAY BP
ZHANG DL
RUSTAD JR
Citation: Bp. Hay et al., STRUCTURAL CRITERIA FOR THE RATIONAL DESIGN OF SELECTIVE LIGANDS .2. EFFECT OF ALKYL SUBSTITUTION ON METAL-ION COMPLEX STABILITY WITH LIGANDS BEARING ETHYLENE-BRIDGED ETHER DONORS, Inorganic chemistry, 35(9), 1996, pp. 2650-2658
Authors:
RUSTAD JR
FELMY AR
HAY BP
Citation: Jr. Rustad et al., MOLECULAR STATICS CALCULATIONS FOR IRON-OXIDE AND OXYHYDROXIDE MINERALS - TOWARD A FLEXIBLE MODEL OF THE REACTIVE MINERAL-WATER INTERFACE, Geochimica et cosmochimica acta, 60(9), 1996, pp. 1553-1562
Authors:
RUSTAD JR
FELMY AR
HAY BP
Citation: Jr. Rustad et al., MOLECULAR STATICS CALCULATIONS OF PROTON BINDING TO GOETHITE SURFACES- A NEW APPROACH TO ESTIMATION OF STABILITY-CONSTANTS FOR MULTISITE SURFACE COMPLEXATION MODELS, Geochimica et cosmochimica acta, 60(9), 1996, pp. 1563-1576
Authors:
HAY BP
RUSTAD JR
ZIPPERER JP
WESTER DW
Citation: Bp. Hay et al., CONFORMATIONAL-ANALYSIS OF CROWN-ETHERS .1. 12-CROWN-4, Journal of molecular structure. Theochem, 337(1), 1995, pp. 39-47
Authors:
RUSTAD JR
HAY BP
HALLEY JW
Citation: Jr. Rustad et al., MOLECULAR-DYNAMICS SIMULATION OF IRON(III) AND ITS HYDROLYSIS PRODUCTS IN AQUEOUS-SOLUTION, The Journal of chemical physics, 102(1), 1995, pp. 427-431
Authors:
REILLY SD
KHALSA GRK
FORD DK
BRAINARD JR
HAY BP
SMITH PH
Citation: Sd. Reilly et al., OCTAAZACRYPTAND COMPLEXATION OF THE FLUORIDE-ION, Inorganic chemistry, 34(3), 1995, pp. 569-575
Authors:
RUSTAD JR
HAY BP
Citation: Jr. Rustad et Bp. Hay, A MOLECULAR-DYNAMICS STUDY OF SOLVATED ORTHOSILICIC ACID AND ORTHOSILICATE ANION USING PARAMETERIZED POTENTIALS, Geochimica et cosmochimica acta, 59(7), 1995, pp. 1251-1257
Authors:
HAY BP
RUSTAD JR
Citation: Bp. Hay et Jr. Rustad, STRUCTURAL CRITERIA FOR THE RATIONAL DESIGN OF SELECTIVE LIGANDS - EXTENSION OF THE MM3 FORCE-FIELD TO ALIPHATIC ETHER COMPLEXES OF THE ALKALI AND ALKALINE-EARTH CATIONS, Journal of the American Chemical Society, 116(14), 1994, pp. 6316-6326
Authors:
HAY BP
Citation: Bp. Hay, METHODS FOR MOLECULAR MECHANICS MODELING OF COORDINATION-COMPOUNDS, Coordination chemistry reviews, 126(1-2), 1993, pp. 177-236
Authors:
HAY BP
RUSTAD JR
HOSTETLER CJ
Citation: Bp. Hay et al., QUANTITATIVE STRUCTURE STABILITY RELATIONSHIP FOR POTASSIUM-ION COMPLEXATION BY CROWN-ETHERS - A MOLECULAR MECHANICS AND AB-INITIO STUDY, Journal of the American Chemical Society, 115(24), 1993, pp. 11158-11164
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