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Browsing by Author Smeyers, Y. G.

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RightsPreviewIssue DateTitleAuthor(s)Type
closedAccessaccesoRestringido.pdf.jpg1993A comparative analysis of the internal rotation in acetone and trans-dimethylglyoxal. Application to the fundamental frequencies and torsional modesSmeyers, Y. G.; Senent, María Luisa  ; Peñalver, F. Y. J.; Moule, D. C.artículo
closedAccessaccesoRestringido.pdf.jpg1993A spectroscopic study of ground state of lithium hydride with the HPHF modelFernández-Serra, P.; Smeyers, Y. G.; Galano, A.; Delgado Barrio, Gerardo  artículo
closedAccessaccesoRestringido.pdf.jpg1994A Theoretical Spectroscopic Study of the Ã1Au(S1) ← X̃1Ag(S0), n → π* Transition in Biacetyl, (CH3CO)2Senent, María Luisa  ; Moule, D. C.; Smeyers, Y. G.; Torolabbe, A.; Peqalver, F. J.artículo
closedAccessaccesoRestringido.pdf.jpg1994A theoretical study of the methyl torsional modes in the a 3Au (T1) ← X 1Ag (S0) n → π* spectrum of biacetylSenent, María Luisa  ; Moule, D. C.; Smeyers, Y. G.; Peñalver, F. J.artículo
closedAccessaccesoRestringido.pdf.jpg1995Ab initio and spectroscope study of dimethyl sulfide. An analysis of the torsinal spectra of (CH3)2S and (CD3)2SSenent, María Luisa  ; Moule, D. C.; Smeyers, Y. G.artículo
openAccessSenent.pdf.jpg1996Ab initio calculations and analysis of the torsional spectra of dimethylamine and dimethylphosphineSenent, María Luisa  ; Smeyers, Y. G.artículo
closedAccessaccesoRestringido.pdf.jpg2003Ab initio comparative study of the structure and properties of H2-porphin and H2-phthalocyanine. The electronic absorption spectraCortina, H.; Senent, María Luisa  ; Smeyers, Y. G.artículo
openAccessSmeyers.pdf.jpg1998Ab initio determination of band structures of vibrational spectra of non-rigid molecules. Applications to methylamine and dimethylamineSmeyers, Y. G.; Senent, María Luisa  ; Villa, M.artículo
closedAccessaccesoRestringido.pdf.jpg1999Ab initio determination of the effect of the C-C bond enlargement, the H wagging and the COH bending, on the torsional frequencies of glyoxalSenent, María Luisa  ; Fernández Herrera, S.; Domínguez Gómez, R. ; Smeyers, Y. G.; Villa, M.artículo
openAccessSenent Díez.pdf.jpg2000Ab initio determination of the far infrared spectra of some isotopic varieties of ethanolSenent, María Luisa  ; Smeyers, Y. G.; Domínguez Gómez, R. ; Villa, M.artículo
closedAccessaccesoRestringido.pdf.jpg2000Ab initio determination of the roto-torsional energy levels of hydrogen peroxideSenent, María Luisa  ; Fernández Herrera, S.; Smeyers, Y. G.artículo
closedAccessaccesoRestringido.pdf.jpg1996Ab initio determination of the torsional and wagging FIR spectrum of methylamineSmeyers, Y. G.; Villa, M.; Senent, María Luisa  artículo
closedAccessaccesoRestringido.pdf.jpg2004Ab Initio Structural Study of Some Substituted Ibuprofen Derivatives as Possible Anti-inflammatory AgentsVilla, M.; Bounaim, L.; Smeyers, N.; Senent, María Luisa  ; Ezamarty, A.; Smeyers, Y. G.artículo
openAccessSmeyers.pdf.jpg1997Ab initio theoretical study of the methyl and phosphine torsion modes in ethylphosphineSmeyers, Y. G.; Meléndez, F. J.; Senent, María Luisa  artículo
openAccessSenent.pdf.jpg1995An ab initio determination of the bending-torsion-torsion spectrum of dimethyl ether, CH3OCH3 and CD3OCD3Senent, María Luisa  ; Moule, D. C.; Smeyers, Y. G.artículo
openAccessSmeyers.pdf.jpg1993An ab initio structural and spectroscopic study of acetone - An analysis of the far infrared torsional spectra of acetone-h6 and -d6Smeyers, Y. G.; Senent, María Luisa  ; Botella, Vicente ; Moule, D. C.artículo
closedAccessaccesoRestringido.pdf.jpg1998An ab initio three-dimensional torsion-torsion-bending analysis of the far infrared spectra of dimethylamineSenent, María Luisa  ; Smeyers, Y. G.; Moule, D. C.artículo
closedAccessaccesoRestringido.pdf.jpg1998An ab initio three-dimensional torsion-torsion-wagging analysis of the far infrared spectra of dimethylamineSenent, María Luisa  ; Smeyers, Y. G.; Moule, D. C.artículo
openAccessmethyl rotation.pdf.jpg30-Aug-1992An analysis of the methyl rotation and aldehyde wagging dynamics in the S0 (X̃ 1A′) and T1 (ã3A″) states of thioacetaldehyde from pyrolysis jet spectraMoule, D. C.; Bascal, H. A.; Smeyers, Y. G.; Clouthier, D. J.; Karolczak, J.; Niño, A.artículo
openAccessMoule.pdf.jpg1991An analysis of the methyl rotation dynamics in the S0 (X̃ 1A1) and T1 (ã 3A2) states of thioacetone, (CH3)2 CS and (CD 3)2 CS from pyrolysis jet spectraMoule, D. C.; Smeyers, Y. G.; Senent, María Luisa  ; Clouthier, D. J.; Karolczak, J.; Judge, R. H.artículo