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Article

Fluorobenzene and p-difluorobenzene microsolvated by methanol: An infrared spectroscopic and ab initio theoretical investigationSCIESCOPUS

JOURNAL OF CHEMICAL PHYSICS, vol. 112, no. 4, page. 1844 - 1858, 2000-01-22

Article

Comparative ab initio study of the structures, energetics and spectra of X-center dot(H2O)(n=1-4) [X=F, Cl, Br, I] clustersSCIESCOPUS

JOURNAL OF CHEMICAL PHYSICS, vol. 113, no. 13, page. 5259 - 5272, 2000-10-01

Article

Structures, vibrational frequencies, and infrared spectra of the hexa-hydrated benzene clustersSCIESCOPUS

JOURNAL OF CHEMICAL PHYSICS, vol. 113, no. 15, page. 6160 - 6168, 2000-10-15

Article

sigma to pi conformational transition: Interactions of the water trimer with pi systemsSCIESCOPUS

JOURNAL OF CHEMICAL PHYSICS, vol. 114, no. 3, page. 1295 - 1305, 2001-01-15

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

Polyenes vs polyynes: Efficient pi-frame for nonlinear optical pathwaysSCIESCOPUS

JOURNAL OF CHEMICAL PHYSICS, vol. 112, no. 1, page. 344 - 348, 2000-01-01

Article

Structure, electronic properties, and vibrational spectra of the water octamer with an extra electron: Ab initio studySCIESCOPUS

JOURNAL OF CHEMICAL PHYSICS, vol. 117, no. 2, page. 706 - 708, 2002-07-08

Article

Structures, energetics, and spectra of fluoride-water clusters F-(H2O)(n), n = 1-6: Ab initio studySCIESCOPUS

JOURNAL OF CHEMICAL PHYSICS, vol. 110, no. 18, page. 9116 - 9127, 1999-05-08

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

Raman intensities of C=C stretching vibrational frequencies of polyenes: Nodal mode analysisSCIESCOPUS

JOURNAL OF CHEMICAL PHYSICS, vol. 107, no. 11, page. 4112 - 4117, 1997-09-15

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