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FormatDateTitleAuthor
FormatDateTitleAuthor
doc icon DUGiDocs 2016 July 19 On the physical origins of interaction-induced vibrational (hyper)polarizabilities Zaleśny, Robert ; Garcia Borràs, Marc ; Góra, Robert W. ; Medved, Miroslav ; Luis Luis, Josep Maria
out url icon Recercat On the physical origins of interaction-induced vibrational (hyper)polarizabilities Zaleśny, Robert ; Garcia Borràs, Marc ; Góra, Robert W. ; Medved, Miroslav ; Luis Luis, Josep Maria
out url icon Recercat 2018 June 1 On the physical origins of interaction-induced vibrational (hyper)polarizabilities
out url icon Recercat 2018 June 5 On the physical origins of interaction-induced vibrational (hyper)polarizabilities Zaleśny, Robert ; Garcia Borràs, Marc ; Góra, Robert W. ; Medved, Miroslav ; Luis Luis, Josep Maria
doc icon DUGiDocs 2016 September Optimization of Conical Intersections in Biological Systems with the ONIOM Scheme: Projected Gradient Implementation in the Microiteration Process Escayola Gordils, Sílvia
out url icon Recercat Optimization of Conical Intersections in Biological Systems with the ONIOM Scheme: Projected Gradient Implementation in the Microiteration Process Escayola Gordils, Sílvia
doc icon DUGiDocs 2012 Performance of PNOF5 Natural Orbital Functional for Radical Formation Reactions: Hydrogen Atom Abstraction and C–C and O–O Homolytic Bond Cleavage in Selected Molecule Lopez, Xabier ; Ruipérez, Fernando ; Piris, Mario ; Matxain, Jon M. ; Matito i Gras, Eduard ; Ugalde, Jesus M.
out url icon Recercat Photoinduced charge separation in the carbon nano-onion C60@C240 Voityuk, Alexander A. ; Solà i Puig, Miquel
out url icon Recercat Photoinduced charge separation in the carbon nano-onion C60@C240 Voityuk, Alexander A. ; Solà i Puig, Miquel
doc icon DUGiDocs 2016 July 6 Photoinduced charge separation in the carbon nano-onion C60@C240 Voityuk, Alexander A. ; Solà i Puig, Miquel
out url icon Recercat 2018 June 1 Photoinduced charge separation in the carbon nano-onion C60@C240
out url icon Recercat 2018 June 5 Photoinduced charge separation in the carbon nano-onion C60@C240 Voityuk, Alexander A. ; Solà i Puig, Miquel
doc icon DUGiDocs 2013 Photophysics of fulvene under the non-resonant stark effect: shaping the conical intersection seam Ruiz-Barragán, Sergi ; Blancafort San José, Lluís
out url icon Recercat Photophysics of fulvene under the non-resonant stark effect: shaping the conical intersection seam Ruiz-Barragán, Sergi ; Blancafort San José, Lluís
doc icon DUGiDocs 2017 June 24 Rational Design of Cyclic Antimicrobial Peptides Based on BPC194 and BPC198 Díaz i Cirac, Anna ; Torné, Maria ; Badosa Romañó, Esther ; Montesinos Seguí, Emilio ; Salvador Sedano, Pedro ; Feliu Soley, Lídia ; Planas i Grabuleda, Marta
out url icon Recercat Rational Design of Cyclic Antimicrobial Peptides Based on BPC194 and BPC198 Díaz i Cirac, Anna ; Torné, Maria ; Badosa Romañó, Esther ; Montesinos Seguí, Emilio ; Salvador Sedano, Pedro ; Feliu Soley, Lídia ; Planas i Grabuleda, Marta
out url icon Recercat Rational Design of Cyclic Antimicrobial Peptides Based on BPC194 and BPC198 Díaz i Cirac, Anna ; Torné, Maria ; Badosa Romañó, Esther ; Montesinos Seguí, Emilio ; Salvador Sedano, Pedro ; Feliu Soley, Lídia ; Planas i Grabuleda, Marta
out url icon Recercat 2018 June 1 Rational Design of Cyclic Antimicrobial Peptides Based on BPC194 and BPC198
out url icon Recercat 2018 June 5 Rational Design of Cyclic Antimicrobial Peptides Based on BPC194 and BPC198 Díaz i Cirac, Anna ; Torné, Maria ; Badosa Romañó, Esther ; Montesinos Seguí, Emilio ; Salvador Sedano, Pedro ; Feliu Soley, Lídia ; Planas i Grabuleda, Marta
doc icon DUGiDocs 2003 Relations among several nuclear and electronic density functional reactivity indexes Torrent Sucarrat, Miquel ; Luis Luis, Josep Maria ; Duran i Portas, Miquel ; Toro-Labbé, Alejandro ; Solà i Puig, Miquel
out url icon Recercat Relations among several nuclear and electronic density functional reactivity indexes Torrent Sucarrat, Miquel ; Luis Luis, Josep Maria ; Duran i Portas, Miquel ; Toro-Labbé, Alejandro ; Solà i Puig, Miquel
doc icon DUGiDocs 1997 The relevance of the Laplacian of intracule and extracule density distributions for analyzing electron-electron interactions in molecules Fradera i Llinàs, Xavier ; Duran i Portas, Miquel ; Mestres i López, Jordi
out url icon Recercat The relevance of the Laplacian of intracule and extracule density distributions for analyzing electron-electron interactions in molecules Fradera i Llinàs, Xavier ; Duran i Portas, Miquel ; Mestres i López, Jordi
doc icon DUGiDocs 2004 Second-order Møller-Plesset perturbation theory without basis set superposition error : II : open-shell systems Salvador Sedano, Pedro ; Mayer, István
out url icon Recercat Second-order Møller-Plesset perturbation theory without basis set superposition error : II : open-shell systems Salvador Sedano, Pedro ; Mayer, István
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