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Pubblicazioni
CHEMICAL PHYSICS
Rivista
Codice:
E035162
ISSN:
0301-0104
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Dati Generali
Pubblicazioni (27)
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Ab initio calculations of oxygen nuclear quadrupole coupling constants and oxygen and silicon NMR shielding constants in molecules containing Si-O bonds
Articolo
Activation free energy for proton transfer in solution
Articolo
Calculation of electric dipole hypershielding at the nuclei in diatomic molecules
Articolo
Computer simulation of dichloromethane. II. Molecular dynamics
Articolo
Constrained molecular dynamics and the mean potential for an ion pair in a polar solvent
Articolo
Dimerization of green sensitizing cyanines in solution. A spectroscopic and theoretical study of the bonding nature
Articolo
Electromagnetic moments and fields induced by nuclear spin, vibrational electric and magnetic field at the nuclei, and nuclear electromagnetic couplings in molecules
Articolo
INTRAMOLECULAR CHARGE-TRANSFER AND TRANS-CIS ISOMERIZATION OF THE DCM STYRENE DYE IN POLAR-SOLVENTS - A CS INDO MRCI STUDY
Articolo
Ion pairing of bisdimethylamino pentamethinecyanine perchlorate and its consequences on the cis-trans photoisomerization dynamics
Articolo
Itinerant oscillation with a cosine potential
Articolo
Matrix trapping site for H atoms trapped in Ne and Ar
Articolo
Molecular dynamics computer simulation of liquid dichloromethane. I. Equilibrium properties
Articolo
Molecular response to a time-independent non-uniform magnetic-field
Articolo
Morphology and trap luminescence in thin oligothiophene films on HOPG
Articolo
NMR chemical shifts of CX and XCY molecules (X,Y=O,S,Se,Te): a comparison of coupled Hartree-Fock, semiempirical REX and experimental results
Articolo
Polarization of cis-trans photoisomerization funnels, size and suddenness
Articolo
Polymorphs of alpha-sexithiophene probed by lattice phonon Raman microscopy
Articolo
Ring current models for acetylene and ethylene molecules
Articolo
Solvent effects within the CS INDO method. Geometrical distortion and solvatochromism of merocyanine dyes
Articolo
Solvent influence on absorption and fluorescence spectra of merocyanine dyes: a theoretical and experimental study
Articolo
Sum rules related to third-order properties: a numerical check
Articolo
TRANS CIS PHOTOISOMERIZATION MECHANISM OF CARBOCYANINES - EXPERIMENTAL CHECK OF THEORETICAL-MODELS
Articolo
The Theory of Sternheimer Shielding in Molecules in External Fields
Articolo
Theoretical and experimental study of the electronic spectrumand photophysics of Michler’s hydrol blue
Articolo
Theoretical determination of paramagnetic susceptibilities from nuclear electromagnetic shieldings
Articolo
Thomas-Reiche-Khun populations in X-CH3 and X-C2H5 series of molecules
Articolo
Thomas-Reiche-Kuhn populations in alkanes
Articolo
No Results Found
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