|
2002 |
Are the maximum hardness and minimum polarizability principles always obeyed in nontotally symmetric vibrations? |
Torrent Sucarrat, Miquel
; Luis Luis, Josep Maria
; Duran i Portas, Miquel
; Solà i Puig, Miquel
|
|
|
Are the maximum hardness and minimum polarizability principles always obeyed in nontotally symmetric vibrations? |
Torrent Sucarrat, Miquel
; Luis Luis, Josep Maria
; Duran i Portas, Miquel
; Solà i Puig, Miquel
|
|
|
|
The aromatic fluctuation index (FLU): a new aromaticity index based on electron delocalization |
Matito i Gras, Eduard
; Duran i Portas, Miquel
; Solà i Puig, Miquel
|
|
|
2005 |
The aromatic fluctuation index (FLU): a new aromaticity index based on electron delocalization |
Matito i Gras, Eduard
; Duran i Portas, Miquel
; Solà i Puig, Miquel
|
|
|
|
The aromatic fluctuation index (FLU): a new aromaticity index based on electron delocalization |
Matito i Gras, Eduard
; Duran i Portas, Miquel
; Solà i Puig, Miquel
|
|
|
5 juny 2018 |
The aromatic fluctuation index (FLU): a new aromaticity index based on electron delocalization |
Matito i Gras, Eduard
; Duran i Portas, Miquel
; Solà i Puig, Miquel
|
|
|
|
Aromaticity as the driving force for the stability of non-IPR endohedral metallofullerene Bingel-Hirsch adducts |
Garcia Borràs, Marc
; Osuna Oliveras, Sílvia
; Swart, Marcel
; Luis Luis, Josep Maria
; Echegoyen, Luis A.
; Solà i Puig, Miquel
|
|
|
2013 |
Aromaticity as the driving force for the stability of non-IPR endohedral metallofullerene Bingel-Hirsch adducts |
Garcia Borràs, Marc
; Osuna Oliveras, Sílvia
; Swart, Marcel
; Luis Luis, Josep Maria
; Echegoyen, Luis A.
; Solà i Puig, Miquel
|
|
|
|
Aromaticity and Magnetic Properties of 1-and 2-Indenones and Their Aza Derivatives |
Poater i Teixidor, Jordi
; Solà i Puig, Miquel
; Alkorta, Ibon
; Elguero, Jose
|
|
|
2014 |
Aromaticity and Magnetic Properties of 1-and 2-Indenones and Their Aza Derivatives |
Poater i Teixidor, Jordi
; Solà i Puig, Miquel
; Alkorta, Ibon
; Elguero, Jose
|
|
|
|
Aromaticity measures from Fuzzy-atom Bond Orders (FBO). The aromatic fluctuation (FLU) and the para-delocalization (PDI) indexes |
Matito i Gras, Eduard
; Salvador Sedano, Pedro
; Duran i Portas, Miquel
; Solà i Puig, Miquel
|
|
|
2006 |
Aromaticity measures from Fuzzy-atom Bond Orders (FBO). The aromatic fluctuation (FLU) and the para-delocalization (PDI) indexes |
Matito i Gras, Eduard
; Salvador Sedano, Pedro
; Duran i Portas, Miquel
; Solà i Puig, Miquel
|
|
|
|
Aromatic properties of 8-hydroxyquinoline and its metal complexes |
Zborowski, Krzysztof K.
; Solà i Puig, Miquel
; Poater i Teixidor, Jordi
; Proniewicz, Leonard M.
|
|
|
1 maig 2013 |
Aromatic properties of 8-hydroxyquinoline and its metal complexes |
Zborowski, Krzysztof K.
; Solà i Puig, Miquel
; Poater i Teixidor, Jordi
; Proniewicz, Leonard M.
|
|
|
|
An Assessment of the Validity of the Maximum Hardness Principle in Chemical Reactions |
Poater i Teixidor, Jordi
; Swart, Marcel
; Solà i Puig, Miquel
|
|
|
2012 |
An Assessment of the Validity of the Maximum Hardness Principle in Chemical Reactions |
Poater i Teixidor, Jordi
; Swart, Marcel
; Solà i Puig, Miquel
|
|
|
2005 |
Basis set effects on the energy and hardness profiles of the hydrogen fluoride dimer |
Torrent Sucarrat, Miquel
; Duran i Portas, Miquel
; Luis Luis, Josep Maria
; Solà i Puig, Miquel
|
|
|
|
Basis set effects on the energy and hardness profiles of the hydrogen fluoride dimer |
Torrent Sucarrat, Miquel
; Duran i Portas, Miquel
; Luis Luis, Josep Maria
; Solà i Puig, Miquel
|
|
|
|
Basis set and electron correlation effects on initial convergence for vibrational nonlinear optical properties of conjugated organic molecules |
Torrent Sucarrat, Miquel
; Solà i Puig, Miquel
; Duran i Portas, Miquel
; Luis Luis, Josep Maria
; Kirtman, Bernard
|
|
|
15 febrer 2020 |
Basis set and electron correlation effects on initial convergence for vibrational nonlinear optical properties of conjugated organic molecules |
Torrent Sucarrat, Miquel
; Solà i Puig, Miquel
; Duran i Portas, Miquel
; Luis Luis, Josep Maria
; Kirtman, Bernard
|
|
|
25 març 2004 |
Basis set and electron correlation effects on initial convergence for vibrational nonlinear optical properties of conjugated organic molecules |
Torrent Sucarrat, Miquel
; Solà i Puig, Miquel
; Duran i Portas, Miquel
; Luis Luis, Josep Maria
; Kirtman, Bernard
|
|
|
|
Bonding description of the Harpoon mechanism |
Rodríguez Mayorga, Mauricio
; Ramos-Cordoba, Eloy
; Salvador Sedano, Pedro
; Solà i Puig, Miquel
; Matito i Gras, Eduard
|
|
|
15 febrer 2020 |
Bonding description of the Harpoon mechanism |
Rodríguez Mayorga, Mauricio
; Ramos-Cordoba, Eloy
; Salvador Sedano, Pedro
; Solà i Puig, Miquel
; Matito i Gras, Eduard
|
|
|
17 abril 2016 |
Bonding description of the Harpoon mechanism |
Rodríguez Mayorga, Mauricio
; Ramos Cordoba, Eloy
; Salvador Sedano, Pedro
; Solà i Puig, Miquel
; Matito i Gras, Eduard
|
|
|
2005 |
Calculation of Franck-Condon factors including anharmonicity: simulation of the C2 H4+ X̃2B 3u←C2 H4X̃1 Ag band in the photoelectron spectrum of ethylene |
Luis Luis, Josep Maria
; Torrent Sucarrat, Miquel
; Solà i Puig, Miquel
; Bishop, David M.
; Kirtman, Bernard
|
