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Results: 1-8 |
Results: 8
AB-INITIO CALCULATIONS AND INTERNAL ROTOR - CONTRIBUTION FOR THERMODYNAMIC PROPERTIES S-298(O) AND C-P(T)S (300-LESS-THAN-T K-LESS-THAN-1500) - GROUP ADDITIVITY FOR FLUOROETHANES/
Authors: YAMADA T LAY TH BOZZELLI JW
Citation: T. Yamada et al., AB-INITIO CALCULATIONS AND INTERNAL ROTOR - CONTRIBUTION FOR THERMODYNAMIC PROPERTIES S-298(O) AND C-P(T)S (300-LESS-THAN-T K-LESS-THAN-1500) - GROUP ADDITIVITY FOR FLUOROETHANES/, The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 102(37), 1998, pp. 7286-7293
COMPARISON OF AM1 AND PM3 IN MOPAC6 WITH LITERATURE FOR THE THERMODYNAMIC PARAMETERS OF C-1 AND C-2 CHLOROCARBONS
Authors: ZHU L BOZZELLI JW LAY TH
Citation: L. Zhu et al., COMPARISON OF AM1 AND PM3 IN MOPAC6 WITH LITERATURE FOR THE THERMODYNAMIC PARAMETERS OF C-1 AND C-2 CHLOROCARBONS, Industrial & engineering chemistry research, 37(8), 1998, pp. 3497-3507
ENTHALPIES OF FORMATION AND GROUP ADDITIVITY OF ALKYL PEROXIDES AND TRIOXIDES
Authors: LAY TH BOZZELLI JW
Citation: Th. Lay et Jw. Bozzelli, ENTHALPIES OF FORMATION AND GROUP ADDITIVITY OF ALKYL PEROXIDES AND TRIOXIDES, The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 101(49), 1997, pp. 9505-9510
THERMODYNAMIC PARAMETERS AND GROUP ADDITIVITY RING CORRECTIONS FOR 3-MEMBERED TO 6-MEMBERED OXYGEN HETEROCYCLIC HYDROCARBONS
Authors: LAY TH YAMADA T TSAI PL BOZZELLI JW
Citation: Th. Lay et al., THERMODYNAMIC PARAMETERS AND GROUP ADDITIVITY RING CORRECTIONS FOR 3-MEMBERED TO 6-MEMBERED OXYGEN HETEROCYCLIC HYDROCARBONS, The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 101(13), 1997, pp. 2471-2477
ENTHALPIES OF FORMATION OF CYCLIC ALKYL PEROXIDES - DIOXANE, 1,2-DIOXETANE, 1,2-DIOXOLANE, AND 1,2-DIOXANE
Authors: LAY TH BOZZELLI JW
Citation: Th. Lay et Jw. Bozzelli, ENTHALPIES OF FORMATION OF CYCLIC ALKYL PEROXIDES - DIOXANE, 1,2-DIOXETANE, 1,2-DIOXOLANE, AND 1,2-DIOXANE, Chemical physics letters, 268(1-2), 1997, pp. 175-179
AB-INITIO STUDY OF ALPHA-CHLORINATED ETHYL HYDROPEROXIDES CH3CH2OOH, CH3CHCLOOH, AND CH3CCL2OOH - CONFORMATIONAL-ANALYSIS, INTERNAL-ROTATION BARRIERS, VIBRATIONAL FREQUENCIES, AND THERMODYNAMIC PROPERTIES
Authors: LAY TH KRASNOPEROV LN VENANZI CA BOZZELLI JW SHOKHIREV NV
Citation: Th. Lay et al., AB-INITIO STUDY OF ALPHA-CHLORINATED ETHYL HYDROPEROXIDES CH3CH2OOH, CH3CHCLOOH, AND CH3CCL2OOH - CONFORMATIONAL-ANALYSIS, INTERNAL-ROTATION BARRIERS, VIBRATIONAL FREQUENCIES, AND THERMODYNAMIC PROPERTIES, Journal of physical chemistry, 100(20), 1996, pp. 8240-8249
ATMOSPHERIC PHOTOCHEMICAL OXIDATION OF BENZENE - BENZENE PLUS OH AND THE BENZENE-OH ADDUCT (HYDROXYL-2,4-CYCLOHEXADIENYL) PLUS O-2
Authors: LAY TH BOZZELLI JW SEINFELD JH
Citation: Th. Lay et al., ATMOSPHERIC PHOTOCHEMICAL OXIDATION OF BENZENE - BENZENE PLUS OH AND THE BENZENE-OH ADDUCT (HYDROXYL-2,4-CYCLOHEXADIENYL) PLUS O-2, Journal of physical chemistry, 100(16), 1996, pp. 6543-6554
HYDROGEN-ATOM BOND INCREMENTS FOR CALCULATION OF THERMODYNAMIC PROPERTIES OF HYDROCARBON RADICAL SPECIES
Authors: LAY TH BOZZELLI JW DEAN AM RITTER ER
Citation: Th. Lay et al., HYDROGEN-ATOM BOND INCREMENTS FOR CALCULATION OF THERMODYNAMIC PROPERTIES OF HYDROCARBON RADICAL SPECIES, Journal of physical chemistry, 99(39), 1995, pp. 14514-14527
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