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Showing results 1 to 20 of 21

Article

A simple rule for classification of polychlorinated dibenzo-p-dioxin congeners on the basis of IR frequency patternsSCIESCOPUS

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, vol. 123, no. 15, page. 3584 - 3587, 2001-04-18

Article

Ab initio investigations on the HOSO2+O-2 -> SO3+HO2 reactionSCIESCOPUS

JOURNAL OF CHEMICAL PHYSICS, vol. 112, no. 2, page. 723 - 730, 2000-01-08

Article

Ab initio study of peroxyacetic nitric anhydride and peroxyacetyl radical: Characteristic infrared band of peroxyacetyl radicalSCIESCOPUS

JOURNAL OF PHYSICAL CHEMISTRY A, vol. 104, no. 12, page. 2613 - 2617, 2000-03-30

Article

Aqua dissociation nature of cesium hydroxideSCIESCOPUS

JOURNAL OF CHEMICAL PHYSICS, vol. 121, no. 1, page. 204 - 208, 2004-07-01

Article

Aqua-potassium(I) complexes: Ab initio studySCIESCOPUS

JOURNAL OF CHEMICAL PHYSICS, vol. 111, no. 9, page. 3995 - 4004, 1999-09-01

Article

DFT calculation on the electron affinity of polychlorinated dibenzo-p-dioxinsSCIESCOPUSKCI

BULLETIN OF THE KOREAN CHEMICAL SOCIETY, vol. 24, no. 6, page. 792 - 796, 2003-06-20

Article

DFT calculation on the thermodynamic properties of polychlorinated dibenzo-p-dioxins: Intramolecular Cl-Cl repulsion effects and their thermochemical implicationsSCIESCOPUS

JOURNAL OF PHYSICAL CHEMISTRY A, vol. 107, no. 15, page. 2693 - 2699, 2003-04-17

Article

Dissociation chemistry of hydrogen halides in waterSCIESCOPUS

JOURNAL OF CHEMICAL PHYSICS, vol. 120, no. 20, page. 9524 - 9535, 2004-05-22

Article

Dissolution of a base (RbOH) by water clustersSCIESCOPUS

JOURNAL OF CHEMICAL PHYSICS, vol. 121, no. 10, page. 4665 - 4670, 2004-09-08

Article

Electron affinity and inversion distortion of dibenzo-p-dioxinSCIESCOPUS

CHEMICAL PHYSICS LETTERS, vol. 410, no. 39816, page. 142 - 146, 2005-07-10

Article

HF(H2O)(n) clusters with an excess electron: Ab initio studySCIESCOPUS

JOURNAL OF CHEMICAL PHYSICS, vol. 121, no. 22, page. 11083 - 11087, 2004-12-08

Article

Hydration and dissociation of hydrogen fluoric acid (HF)SCIESCOPUS

JOURNAL OF PHYSICAL CHEMISTRY A, vol. 110, no. 25, page. 7918 - 7924, 2006-06-29

Article

Hydrogen detachment of the hexahydrated hydroiodic acid upon attaching an excess electronSCIESCOPUS

MOLECULAR PHYSICS, vol. 105, no. 19-22, page. 2577 - 2581, 2007-01

Article

Intramolecular charge transfer of pi-conjugated push-pull systems in terms of polarizability and electronegativitySCIESCOPUS

JOURNAL OF CHEMICAL PHYSICS, vol. 115, no. 20, page. 9484 - 9489, 2001-11-22

Article

New quantum chemical parameter for the substituent effect in benzene based on charge fluxSCIESCOPUS

JOURNAL OF PHYSICAL CHEMISTRY A, vol. 107, no. 19, page. 3577 - 3579, 2003-05-15

Article

Photoswitch and nonlinear optical switch: Theoretical studies on 1,2-bis-(3-thienyl)-ethene derivativesSCIESCOPUS

JOURNAL OF CHEMICAL PHYSICS, vol. 111, no. 13, page. 5866 - 5872, 1999-10-01

Article

Roles of central and terminal carbon atoms in infrared and Raman intensities of polyenes: Analysis of atomic polar and polarizability tensorsSCIESCOPUS

JOURNAL OF CHEMICAL PHYSICS, vol. 107, no. 13, page. 4881 - 4885, 1997-10-01

Article

Size scaling of intramolecular charge transfer driven optical properties of substituted polyenes and polyynesSCIESCOPUS

JOURNAL OF CHEMICAL PHYSICS, vol. 119, no. 14, page. 7519 - 7524, 2003-10-08

Article

Solvent-specific photolytic behavior of octachlorodibenzo-p-dioxinSCIESCOPUS

ENVIRONMENTAL SCIENCE & TECHNOLOGY, vol. 38, no. 7, page. 2082 - 2088, 2004-04-01

Article

Theoretical study on the reaction of OH radicals with polychlorinated dibenzo-p-dioxinsSCIESCOPUS

JOURNAL OF PHYSICAL CHEMISTRY A, vol. 108, no. 4, page. 607 - 614, 2004-01-29

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