Registro:
Documento: |
Artículo
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Título: | Modeling solid-state effects on NMR chemical shifts using electrostatic models |
Autor: | Di Fiori, N.; Orendt, A.M.; Caputo, M.C.; Ferraro, M.B.; Facelli, J.C. |
Filiación: | Departamento de F́isica, Facultad de Ciencias Exactas y Naturales, Universidad de Buenos Aires, Ciudad Universitaria, Pab. I, (1428) Buenos Aires, Argentina Center for High Performance Computing, University of Utah, Salt Lake City, UT 84112, United States
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Palabras clave: | Chemical shielding calculations; EIM; NMR; Point charge methods; SCREEP; Solid-state effects; carbon; nitrogen; algorithm; article; chemical model; electrochemistry; factual database; hydrogen bond; normal distribution; nuclear magnetic resonance spectroscopy; statistics; Algorithms; Carbon Isotopes; Databases, Factual; Electrochemistry; Hydrogen Bonding; Magnetic Resonance Spectroscopy; Models, Chemical; Nitrogen Isotopes; Normal Distribution |
Año: | 2004
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Volumen: | 42
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Número: | SPLISS1
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Página de inicio: | S41
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Página de fin: | S47
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DOI: |
http://dx.doi.org/10.1002/mrc.1432 |
Título revista: | Magnetic Resonance in Chemistry
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Título revista abreviado: | Magn. Reson. Chem.
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ISSN: | 07491581
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CODEN: | MRCHE
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CAS: | carbon, 7440-44-0; nitrogen, 7727-37-9; Carbon Isotopes; Nitrogen Isotopes
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Registro: | https://bibliotecadigital.exactas.uba.ar/collection/paper/document/paper_07491581_v42_nSPLISS1_pS41_DiFiori |
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Citas:
---------- APA ----------
Di Fiori, N., Orendt, A.M., Caputo, M.C., Ferraro, M.B. & Facelli, J.C.
(2004)
. Modeling solid-state effects on NMR chemical shifts using electrostatic models. Magnetic Resonance in Chemistry, 42(SPLISS1), S41-S47.
http://dx.doi.org/10.1002/mrc.1432---------- CHICAGO ----------
Di Fiori, N., Orendt, A.M., Caputo, M.C., Ferraro, M.B., Facelli, J.C.
"Modeling solid-state effects on NMR chemical shifts using electrostatic models"
. Magnetic Resonance in Chemistry 42, no. SPLISS1
(2004) : S41-S47.
http://dx.doi.org/10.1002/mrc.1432---------- MLA ----------
Di Fiori, N., Orendt, A.M., Caputo, M.C., Ferraro, M.B., Facelli, J.C.
"Modeling solid-state effects on NMR chemical shifts using electrostatic models"
. Magnetic Resonance in Chemistry, vol. 42, no. SPLISS1, 2004, pp. S41-S47.
http://dx.doi.org/10.1002/mrc.1432---------- VANCOUVER ----------
Di Fiori, N., Orendt, A.M., Caputo, M.C., Ferraro, M.B., Facelli, J.C. Modeling solid-state effects on NMR chemical shifts using electrostatic models. Magn. Reson. Chem. 2004;42(SPLISS1):S41-S47.
http://dx.doi.org/10.1002/mrc.1432