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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Reply to comment on 'The enthalpy of the O-H bond homolytic dissociation basis-set extrapolated density functionaltheory and coupled cluster calculationsB J C Cabral Sylvio CanutoChemical Physics Lettes v. 417, n. 4-6, p. 570-572, 2006Amsterdam 2006Acesso online |
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2 |
Material Type: Artigo
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Reply to comment on 'The enthalpy of the O-H bond homolytic dissociation basis-set extrapolated density functionaltheory and coupled cluster calculationsB J C Cabral Sylvio CanutoChemical Physics Lettes v. 417, n. 4-6, p. 570-572, 2006Amsterdam 2006Acesso online |
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3 |
Material Type: Artigo
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Can larger dipoles solvate less? solute-solvent hydrogen bond and the differential solvation of phenol and phenoxyKaline Rabelo Coutinho B J C Cabral; Sylvio CanutoChemical Physics Letters v. 399, n. 4-6, p. 534-538, 2004Amsterdam 2004Acesso online |
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4 |
Material Type: Artigo
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Can larger dipoles solvate less? solute-solvent hydrogen bond and the differential solvation of phenol and phenoxyKaline Rabelo Coutinho B J C Cabral; Sylvio CanutoChemical Physics Letters v. 399, n. 4-6, p. 534-538, 2004Amsterdam 2004Acesso online |
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5 |
Material Type: Artigo
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Electronic properties of liquid hydrogen fluoride: A sequential quantum mechanical/Born–Oppenheimer molecular dynamics approachBenedito J Costa Cabral Kaline Rabelo Coutinho; Sylvio CanutoChemical Physics Letters V.495, N.1-3, 2010Amsterdan 2010Acesso online |
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6 |
Material Type: Artigo
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Electronic polarization of liquid water converged Monte-Carlo quantum mechanics results for the multipole momentsKaline Rabelo Coutinho R C Guedes; B J Costa Cabral; Sylvio CanutoChemical Physics Letters Amsterdam v. 369, n. 3-4, p. 345-353, 2003Amsterdam 2003Acesso online |
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7 |
Material Type: Artigo
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Differential hydration of phenol and phenoxy radical and the energetics of the phenol O-H bond in solutionR C Guedes Kaline Rabelo Coutinho; B J Costa Cabral; Sylvio CanutoJournal of Physical Chemistry B v. 107, n. 18, p. 4304-4310, 2003Washington, D.C. 2003Acesso online |
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8 |
Material Type: Artigo
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Electronic polarization in liquid acetonitrile a sequential Monte Carlo/quantum mechanics investigationRoberto Rivelino B J Costa Cabral; Kaline Rabelo Coutinho; Sylvio CanutoChemical Physics Letters v. 407, n. 1-3. p. 13-17, 2005Amsterdam 2005Acesso online |
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9 |
Material Type: Artigo
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Electron binding energies of water clusters implications for the electronic properties of liquid waterPaulo Cabral do Couto Benedito J Costa Cabral; Sylvio CanutoChemical Physics Letters Amsterdam v. 429, n. 1-3, p. 129-135, 2006Amsterdam 2006Acesso online |
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10 |
Material Type: Artigo
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Electronic properties of liquid ammonia a sequential molecular dynamics/quantum mechanics approachTania S Almeida Kaline Rabelo Coutinho; Benedito J Costa Cabral; Sylvio CanutoJournal of Chemical Physics v. 128, n. 1, p. 014506/1-014506/9, 2008New York 2008Acesso online |