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4 febrer 2011 |
Analysis of chemical bonding and aromaticity from electronic delocalization descriptors |
Feixas Geronès, Ferran
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Analysis of chemical bonding and aromaticity from electronic delocalization descriptors |
Feixas Geronès, Ferran
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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
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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
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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
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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
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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
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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
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Benchmark calculations of metal carbonyl cations: Relativistic vs. electron correlation effects |
Matito i Gras, Eduard
; Salvador Sedano, Pedro
; Styszyński, Jacek
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2013 |
Benchmark calculations of metal carbonyl cations: Relativistic vs. electron correlation effects |
Matito i Gras, Eduard
; Salvador Sedano, Pedro
; Styszyński, Jacek
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Benchmark calculations on the lowest-energy singlet, triplet, and quintet states of the four-electron harmonium atom |
Cioslowski, Jerzy
; Strasburger, Krzysztof
; Matito i Gras, Eduard
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Benchmark calculations on the lowest-energy singlet, triplet, and quintet states of the four-electron harmonium atom |
Cioslowski, Jerzy
; Strasburger, Krzysztof
; Matito i Gras, Eduard
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5 juny 2018 |
Benchmark calculations on the lowest-energy singlet, triplet, and quintet states of the four-electron harmonium atom |
Cioslowski, Jerzy
; Strasburger, Krzysztof
; Matito i Gras, Eduard
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Benchmark calculations on the lowest-energy singlet, triplet, and quintet states of the four-electron harmonium atom |
Cioslowski, Jerzy
; Strasburger, Krzysztof
; Matito i Gras, Eduard
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6 juliol 2010 |
Benchmark full configuration interaction calculations for the ground state of three-electron harmonium atoms |
Matito i Gras, Eduard
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Bonding description of the Harpoon mechanism |
RodrÃguez Mayorga, Mauricio
; Ramos-Cordoba, Eloy
; Salvador Sedano, Pedro
; Solà i Puig, Miquel
; Matito i Gras, Eduard
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15 febrer 2020 |
Bonding description of the Harpoon mechanism |
RodrÃguez Mayorga, Mauricio
; Ramos-Cordoba, Eloy
; Salvador Sedano, Pedro
; Solà i Puig, Miquel
; Matito i Gras, Eduard
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17 abril 2016 |
Bonding description of the Harpoon mechanism |
RodrÃguez Mayorga, Mauricio
; Ramos Cordoba, Eloy
; Salvador Sedano, Pedro
; Solà i Puig, Miquel
; Matito i Gras, Eduard
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A Critical Assessment of the Performance of Magnetic and Electronic Indices of Aromaticity |
Solà i Puig, Miquel
; Feixas Geronès, Ferran
; Jiménez Halla, José Óscar Carlos
; Matito i Gras, Eduard
; Poater i Teixidor, Jordi
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A Critical Assessment of the Performance of Magnetic and Electronic Indices of Aromaticity |
Solà i Puig, Miquel
; Feixas Geronès, Ferran
; Jiménez Halla, José Óscar Carlos
; Matito i Gras, Eduard
; Poater i Teixidor, Jordi
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5 juny 2018 |
A Critical Assessment of the Performance of Magnetic and Electronic Indices of Aromaticity |
Solà i Puig, Miquel
; Feixas Geronès, Ferran
; Jiménez Halla, José Óscar Carlos
; Matito i Gras, Eduard
; Poater i Teixidor, Jordi
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15 febrer 2020 |
A Critical Assessment of the Performance of Magnetic and Electronic Indices of Aromaticity |
Solà i Puig, Miquel
; Feixas Geronès, Ferran
; Jiménez Halla, José Óscar Carlos
; Matito i Gras, Eduard
; Poater i Teixidor, Jordi
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2010 |
A Critical Assessment of the Performance of Magnetic and Electronic Indices of Aromaticity |
Solà i Puig, Miquel
; Feixas Geronès, Ferran
; Jiménez Halla, José Óscar Carlos
; Matito i Gras, Eduard
; Poater i Teixidor, Jordi
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7 juliol 2006 |
Development, implementation and application of electronic structural descriptors to the analysis of the chemical bonding, aromaticity and chemical reactivity |
Matito i Gras, Eduard
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7 juliol 2006 |
Development, implementation and application of electronic structural descriptors to the analysis of the chemical bonding, aromaticity and chemical reactivity |
Matito i Gras, Eduard
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