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153 items found

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FormatDateTitleAuthor
FormatDateTitleAuthor
doc icon DUGiDocs 2004 The hardness profile as a tool to detect spurious stationary points in the potential energy surface Torrent Sucarrat, Miquel ; Luis Luis, Josep Maria ; Duran i Portas, Miquel ; Solà i Puig, Miquel
out url icon Recercat The hardness profile as a tool to detect spurious stationary points in the potential energy surface Torrent Sucarrat, Miquel ; Luis Luis, Josep Maria ; Duran i Portas, Miquel ; Solà i Puig, Miquel
doc icon DUGiDocs 1996 How does basis set superposition error change the potential surfaces for hydrogen-bonded dimers? Simon i Rabasseda, Sílvia ; Duran i Portas, Miquel ; Dannenberg, J. J.
out url icon Recercat How does basis set superposition error change the potential surfaces for hydrogen-bonded dimers? Simon i Rabasseda, Sílvia ; Duran i Portas, Miquel ; Dannenberg, J. J.
doc icon TDX 2001 December 20 Implementation and application of basis set superposition error-correction schemes to the theoretical modeling of weak intermolecular interactions Salvador Sedano, Pedro
out url icon Recercat Implementation and application of basis set superposition error-correction schemes to the theoretical modeling of weak intermolecular interactions Salvador Sedano, Pedro
media icon DUGiMedia 2009 October 26 Inauguraci√≥ curs 2009-2010. ‚ÄôM√ļsica i Salut‚Äô Brugada, Ramon ; Pedrerol, Marta ; Perich, Pepita ; Casal, Luz ; Duran i Portas, Miquel
doc icon TDX 2003 April 28 √ćndexos de localitzaci√≥ i deslocalitzaci√≥ derivats de la densitat bielectr√≤nica: an√†lisi i aplicacions en estructura molecular, reactivitat qu√≠mica i aromaticitat Poater i Teixidor, Jordi
out url icon Recercat √ćndexos de localitzaci√≥ i deslocalitzaci√≥ derivats de la densitat bielectr√≤nica: an√†lisi i aplicacions en estructura molecular, reactivitat qu√≠mica i aromaticitat Poater i Teixidor, Jordi
doc icon DUGiDocs 2002 Initial convergence of the perturbation series expansion for vibrational nonlinear optical properties Torrent Sucarrat, Miquel ; Solà i Puig, Miquel ; Duran i Portas, Miquel ; Luis Luis, Josep Maria ; Kirtman, Bernard
out url icon Recercat Initial convergence of the perturbation series expansion for vibrational nonlinear optical properties Torrent Sucarrat, Miquel ; Solà i Puig, Miquel ; Duran i Portas, Miquel ; Luis Luis, Josep Maria ; Kirtman, Bernard
doc icon TDX 1998 July 24 Interaccions moleculars: correcció de l’error de superposició de base i propietat de les funcions flotants Simon i Rabasseda, Sílvia
out url icon Recercat Interaccions moleculars: correcció de l’error de superposició de base i propietat de les funcions flotants Simon i Rabasseda, Sílvia
doc icon DUGiDocs 2008 Intramolecular basis set superposition error effects on the planarity of benzene and other aromatic molecules: A solution to the problem Asturiol Bofill, David ; Duran i Portas, Miquel ; Salvador Sedano, Pedro
out url icon Recercat Intramolecular basis set superposition error effects on the planarity of benzene and other aromatic molecules: A solution to the problem Asturiol Bofill, David ; Duran i Portas, Miquel ; Salvador Sedano, Pedro
out url icon Recercat Is coronene better described by Clar‚Äôs aromatic ŌÄ-sextet model or by the AdNDP representation? Kumar, Anand ; Duran i Portas, Miquel ; Sol√† i Puig, Miquel
out url icon Recercat Is coronene better described by Clar‚Äôs aromatic ŌÄ-sextet model or by the AdNDP representation? Kumar, Anand ; Duran i Portas, Miquel ; Sol√† i Puig, Miquel
out url icon Recercat Is coronene better described by Clar‚Äôs aromatic ŌÄ-sextet model or by the AdNDP representation? Kumar, Anand ; Duran i Portas, Miquel ; Sol√† i Puig, Miquel
out url icon Recercat 2018 June 5 Is coronene better described by Clar‚Äôs aromatic ŌÄ-sextet model or by the AdNDP representation? Kumar, Anand ; Duran i Portas, Miquel ; Sol√† i Puig, Miquel
out url icon Recercat 2020 February 15 Is coronene better described by Clar‚Äôs aromatic ŌÄ-sextet model or by the AdNDP representation? Kumar, Anand ; Duran i Portas, Miquel ; Sol√† i Puig, Miquel
doc icon DUGiDocs Is coronene better described by Clar‚Äôs aromatic ŌÄ-sextet model or by the AdNDP representation? Kumar, Anand ; Duran i Portas, Miquel ; Sol√† i Puig, Miquel
doc icon TDX 2006 April 24 Isomerism and C-H, C-C, O-O, C-O bond activation studies by transition metals Poater Teixidor, Albert
out url icon Recercat Isomerism and C-H, C-C, O-O, C-O bond activation studies by transition metals Poater Teixidor, Albert
media icon DUGiMedia 2009 February 13 Jornades de portes obertes (I) Feliu, Francesc ; Villanova, José Luis ; Geli, Anna M. ; Duran i Portas, Miquel ; Brugada, Ramon
doc icon DUGiDocs 2008 June 2 Laquímica.net, una proposta per millorar la relació entre universitat i la secundària Solà i Puig, Miquel ; Duran i Portas, Miquel ; Planas i Grabuleda, Marta ; Duran i Carpintero, Josep
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