Result Number | Material Type | Add to My Shelf Action | Record Details and Options |
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1 |
Material Type: Artigo
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13C-detected NMR experiments for automatic resonance assignment of IDPs and multiple-fixing SMFT processingDziekański, Paweł ; Grudziąż, Katarzyna ; Jarvoll, Patrik ; Koźmiński, Wiktor ; Zawadzka-Kazimierczuk, AnnaJournal of biomolecular NMR, 2015, Vol.62 (2), p.179-190 [Periódico revisado por pares]Dordrecht: Springer NetherlandsTexto completo disponível |
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2 |
Material Type: Artigo
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13C-Substituted pentos-2-uloses: synthesis and analysis by 1H- and 13C-n.m.r. spectroscopyVuorinen, Tapani ; Serianni, Anthony S.Carbohydrate research, 1990-10, Vol.207 (2), p.185-210 [Periódico revisado por pares]Oxford: Elsevier LtdTexto completo disponível |
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3 |
Material Type: Artigo
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Ab initio analysis of silyl precursor physisorption and hydrogen abstraction during low temperature silicon depositionGupta, A. ; Yang, H. ; Parsons, G.N.Surface science, , Vol.496 (3), p.307-317 [Periódico revisado por pares]Lausanne: Elsevier B.VTexto completo disponível |
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4 |
Material Type: Artigo
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Ab Initio and MM3 Studies of the Conformational Structures of Naphthalene Trimer: Comparison with ExperimentGonzalez, Carlos ; Lim, Edward CThe journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 1999-03, Vol.103 (11), p.1437-1441 [Periódico revisado por pares]American Chemical SocietyTexto completo disponível |
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5 |
Material Type: Artigo
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Ab initio based tight-binding molecular dynamics simulation of the sticking and scattering of O 2 ∕ Pt ( 111 )Groß, A ; Eichler, A ; Hafner, J ; Mehl, M J ; Papaconstantopoulos, D AThe Journal of chemical physics, 2006-05, Vol.124 (17), p.174713-174713-7 [Periódico revisado por pares]American Institute of PhysicsTexto completo disponível |
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6 |
Material Type: Artigo
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Ab initio calculations of structures and interaction energies of toluene dimers including CCSD(T) level electron correlation correctionTsuzuki, Seiji ; Honda, Kazumasa ; Uchimaru, Tadafumi ; Mikami, MasuhiroThe Journal of chemical physics, 2005-04, Vol.122 (14), p.144323-144323 [Periódico revisado por pares]United StatesTexto completo disponível |
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7 |
Material Type: Artigo
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Ab initio characterization of the Ne-I 2 van der Waals complex: Intermolecular potentials and vibrational bound statesDelgado-Tellez, Laura ; Valdés, Álvaro ; Prosmiti, Rita ; Villarreal, Pablo ; Delgado-Barrio, GerardoThe Journal of chemical physics, 2011-06, Vol.134 (21), p.214304-214304-9 [Periódico revisado por pares]American Institute of PhysicsTexto completo disponível |
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8 |
Material Type: Artigo
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Ab initio potential energy surface and bound states for the Kr-OCS complexFeng, Eryin ; Sun, Chunyan ; Yu, Chunhua ; Shao, Xi ; Huang, WuyingThe Journal of chemical physics, 2011-09, Vol.135 (12), p.124301-124301-6 [Periódico revisado por pares]United States: American Institute of PhysicsTexto completo disponível |
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9 |
Material Type: Artigo
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Ab initio studies on hydrogen-bonded trimers: structure and vibrational spectra of HCN(HF) 2 and (HCN) 2HFKarpfen, Alfred ; Kurnig, Ingrid J. ; Lischka, HansJournal of molecular structure. Theochem, 1991-03, Vol.227, p.337-350Amsterdam: Elsevier B.VTexto completo disponível |
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10 |
Material Type: Artigo
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Ab initio studies on the van der Waals complexes of polycyclic aromatic hydrocarbons. I. Benzene–naphthalene complexLee, Nam Ki ; Park, Soonyong ; Kim, Seong KeunThe Journal of chemical physics, 2002-05, Vol.116 (18), p.7902-7909 [Periódico revisado por pares]Texto completo disponível |