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FormatDateTitleAuthor
FormatDateTitleAuthor
out url icon Recercat 2018 June 1 Critical thoughts on computing atom condensed Fukui functions
out url icon Recercat 2018 June 5 Critical thoughts on computing atom condensed Fukui functions Bultinck, Patrick ; Fias, Stijn ; Alsenoy, Christian van ; Ayers, Paul W. ; Carbó-Dorca, Ramon
doc icon DUGiDocs 2005 Density functional energy decomposition into one- and two-atom contributions Vyboishchikov, Sergei F. ; Salvador Sedano, Pedro ; Duran i Portas, Miquel
out url icon Recercat Density functional energy decomposition into one- and two-atom contributions Vyboishchikov, Sergei F. ; Salvador Sedano, Pedro ; Duran i Portas, Miquel
out url icon Recercat Density functional study on UV/VIS spectra of copper-protein active sites: the effect of mutations Swart, Marcel ; Johansson, Mikael P.
doc icon DUGiDocs 2012 September 1 Density functional study on UV/VIS spectra of copper-protein active sites: the effect of mutations Swart, Marcel ; Johansson, Mikael P.
doc icon DUGiDocs 2014 A density functional study of the spin state energetics of polypyrazolylborato complexes of first-row transition metals Gruden-Pavlović, Maja ; Stepanović, Stepan ; Perić, M. ; Güell Serra, Mireia ; Swart, Marcel
out url icon Recercat A density functional study of the spin state energetics of polypyrazolylborato complexes of first-row transition metals Gruden-Pavlović, Maja ; Stepanović, Stepan ; Perić, M. ; Güell Serra, Mireia ; Swart, Marcel
doc icon DUGiDocs 2013 Density functional study of ternary FexCoy Niz (x + y + z = 7) clusters Guzmán-Ramírez, Gregorio ; Salvador Sedano, Pedro ; Robles, Juvencio ; Vega, Andrés ; Aguilera-Granja, Faustino
out url icon Recercat Density functional study of ternary FexCoy Niz (x + y + z = 7) clusters Guzmán-Ramírez, Gregorio ; Salvador Sedano, Pedro ; Robles, Juvencio ; Vega, Andrés ; Aguilera-Granja, Faustino
doc icon DUGiDocs 2012 Description and solution of an unreported intrinsic bias in photon mapping density estimation with constant kernel García Hernandez, Rubén Jesús ; Ureña, Carlos ; Sbert, Mateu
out url icon Recercat Description and solution of an unreported intrinsic bias in photon mapping density estimation with constant kernel García Hernandez, Rubén Jesús ; Ureña, Carlos ; Sbert, Mateu
out url icon Recercat Design of dinuclear copper species with carboranylcarboxylate ligands: study of their steric and electronic effects Fontanet, Mònica ; Popescu, Adrian Radu ; Fontrodona, Xavier ; Rodríguez Pizarro, Montserrat ; Romero García, Isabel ; Teixidor, Francesc ; Viñas, Clara ; Aliaga Alcalde, Núria ; Ruiz, Eliseo
doc icon DUGiDocs 2011 November 18 Design of dinuclear copper species with carboranylcarboxylate ligands: study of their steric and electronic effects Fontanet, Mònica ; Popescu, Adrian Radu ; Fontrodona, Xavier ; Rodríguez Pizarro, Montserrat ; Romero García, Isabel ; Teixidor Bombardó, Francesc ; Viñas, Clara ; Aliaga Alcalde, Núria ; Ruiz, Eliseo
doc icon DUGiDocs 2014 April 1 Dinuclear ru-aqua complexes for selective epoxidation catalysis based on supramolecular substrate orientation effects Di Giovanni, Carlo ; Poater Teixidor, Albert ; Benet Buchholz, Jordi ; Cavallo, Luigi ; SolĂ  i Puig, Miquel ; Llobet Dalmases, Antoni
out url icon Recercat Dinuclear ru-aqua complexes for selective epoxidation catalysis based on supramolecular substrate orientation effects Di Giovanni, Carlo ; Poater Teixidor, Albert ; Benet Buchholz, Jordi ; Cavallo, Luigi ; SolĂ  i Puig, Miquel ; Llobet Dalmases, Antoni
doc icon DUGiDocs 2012 October 8 Direct detection of key intermediates in rhodium(I)-catalyzed [2+2+2] cycloadditions of alkynes by ESI-MS Parera BriansĂł, Magda ; Dachs Soler, Anna ; SolĂ  i Puig, Miquel ; Pla i Quintana, Anna ; Roglans i Ribas, Anna
out url icon Recercat Direct detection of key intermediates in rhodium(I)-catalyzed [2+2+2] cycloadditions of alkynes by ESI-MS Parera BriansĂł, Magda ; Dachs Soler, Anna ; SolĂ  i Puig, Miquel ; Pla i Quintana, Anna ; Roglans i Ribas, Anna
doc icon DUGiDocs 2017 July 24 Does the endohedral borospherene supersalt FLi2@B39 maintain the “super” properties of its subunits? Stasyuk, Anton J. ; Solà i Puig, Miquel
out url icon Recercat Does the endohedral borospherene supersalt FLi2@B39 maintain the “super” properties of its subunits? Stasyuk, Anton J. ; Solà i Puig, Miquel
out url icon Recercat Does the endohedral borospherene supersalt FLi2@B39 maintain the “super” properties of its subunits? Stasyuk, Anton J. ; Solà i Puig, Miquel
out url icon Recercat 2018 June 1 Does the endohedral borospherene supersalt FLi2@B39 maintain the “super” properties of its subunits?
out url icon Recercat 2018 June 5 Does the endohedral borospherene supersalt FLi2@B39 maintain the “super” properties of its subunits? Stasyuk, Anton J. ; Solà i Puig, Miquel
out url icon Recercat The Driving Force of Photoinduced Charge Separation in Metal-Cluster-Encapsulated Triphenylamine-[80]fullerenes MartĂ­nez, Juan Pablo ; SolĂ  i Puig, Miquel ; Voityuk, Alexander A.
out url icon Recercat The Driving Force of Photoinduced Charge Separation in Metal-Cluster-Encapsulated Triphenylamine-[80]fullerenes MartĂ­nez, Juan Pablo ; SolĂ  i Puig, Miquel ; Voityuk, Alexander A.
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