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2018 June 5 |
Communication: An approximation to Bader鈥檚 topological atom |
Salvador Sedano, Pedro
; Ramos-Cordoba, Eloy
|
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2013 August |
Communication: An approximation to Bader鈥檚 topological atom |
Salvador Sedano, Pedro
; Ramos Cordoba, Eloy
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Complete 蟽* intramolecular aromatic hydroxylation mechanism through O2 activation by a Schiff base macrocyclic dicopper (I) complex |
Poater Teixidor, Albert
; Sol脿 i Puig, Miquel
|
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Complete 蟽* intramolecular aromatic hydroxylation mechanism through O2 activation by a Schiff base macrocyclic dicopper (I) complex |
Poater Teixidor, Albert
; Sol脿 i Puig, Miquel
|
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2013 |
Complete 蟽* intramolecular aromatic hydroxylation mechanism through O2 activation by a Schiff base macrocyclic dicopper (I) complex |
Poater Teixidor, Albert
; Sol脿 i Puig, Miquel
|
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Complexes of adamantine-based group 13 Lewis acids and superacids: bonding analysis and thermodynamics of hydrogen splitting |
El Hamdi Lahfid, Majid
; Sol脿 i Puig, Miquel
; Poater i Teixidor, Jordi
; Timoshkin, A.
|
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|
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Complexes of adamantine-based group 13 Lewis acids and superacids: bonding analysis and thermodynamics of hydrogen splitting |
El Hamdi Lahfid, Majid
; Sol脿 i Puig, Miquel
; Poater i Teixidor, Jordi
; Timoshkin, A.
|
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2018 June 1 |
Complexes of adamantine-based group 13 Lewis acids and superacids: bonding analysis and thermodynamics of hydrogen splitting |
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2018 June 5 |
Complexes of adamantine-based group 13 Lewis acids and superacids: bonding analysis and thermodynamics of hydrogen splitting |
El Hamdi Lahfid, Majid
; Sol脿 i Puig, Miquel
; Poater i Teixidor, Jordi
; Timoshkin, A.
|
|
|
2016 June 5 |
Complexes of adamantine-based group 13 Lewis acids and superacids: bonding analysis and thermodynamics of hydrogen splitting |
El Hamdi Lahfid, Majid
; Sol脿 i Puig, Miquel
; Poater i Teixidor, Jordi
; Timoshkin, A.
|
|
|
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Critical analysis and extension of the Hirshfeld atoms in molecules |
Bultinck, Patrick
; Van Alsenoy, Christian
; Ayers, Paul W.
; Carb贸-Dorca, Ramon
|
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2007 |
Critical analysis and extension of the Hirshfeld atoms in molecules |
Bultinck, Patrick
; Alsenoy, Christian聽van
; Ayers, Paul W.
; Carb贸-Dorca, Ramon
|
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2018 June 1 |
Critical analysis and extension of the Hirshfeld atoms in molecules |
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2018 June 5 |
Critical analysis and extension of the Hirshfeld atoms in molecules |
Bultinck, Patrick
; Alsenoy, Christian聽van
; Ayers, Paul W.
; Carb贸-Dorca, Ramon
|
|
|
2020 February 15 |
Critical analysis and extension of the Hirshfeld atoms in molecules |
Bultinck, Patrick
; Alsenoy, Christian聽van
; Ayers, Paul W.
; Carb贸-Dorca, Ramon
|
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|
2006 |
Cuestionada la interpretaci贸n de Bader sobre el significado de los puntos cr铆ticos de enlace |
Poater i Teixidor, Jordi
; Sol脿 i Puig, Miquel
; Bickelhaupt, Friedrich Matthias
|
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|
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Cuestionada la interpretaci贸n de Bader sobre el significado de los puntos cr铆ticos de enlace |
Poater i Teixidor, Jordi
; Sol脿 i Puig, Miquel
; Bickelhaupt, F. Matthias
|
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|
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Cuestionada la interpretaci贸n de Bader sobre el significado de los puntos cr铆ticos de enlace |
Poater i Teixidor, Jordi
; Sol脿 i Puig, Miquel
; Bickelhaupt, F. Matthias
|
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2018 June 1 |
Cuestionada la interpretaci贸n de Bader sobre el significado de los puntos cr铆ticos de enlace |
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2018 June 5 |
Cuestionada la interpretaci贸n de Bader sobre el significado de los puntos cr铆ticos de enlace |
Poater i Teixidor, Jordi
; Sol脿 i Puig, Miquel
; Bickelhaupt, F. Matthias
|
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2004 |
The curvature of the conical intersection seam: an approximate second-order analysis |
Paterson, Martin J.
; Bearpark, Michael J.
; Robb, Michael A.
; Blancafort San Jos茅, Llu铆s
|
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|
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The curvature of the conical intersection seam: an approximate second-order analysis |
Paterson, Martin J.
; Bearpark, Michael J.
; Robb, Michael A.
; Blancafort San Jos茅, Llu铆s
|
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2005 |
Density functional energy decomposition into one- and two-atom contributions |
Vyboishchikov, Sergei F.
; Salvador Sedano, Pedro
; Duran i Portas, Miquel
|
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Density functional energy decomposition into one- and two-atom contributions |
Vyboishchikov, Sergei F.
; Salvador Sedano, Pedro
; Duran i Portas, Miquel
|
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2000 |
Determination of vibrational polarizabilities and hyperpolarizabilities using field-induced coordinates |
Luis Luis, Josep Maria
; Duran i Portas, Miquel
; Champagne, Beno卯t
; Kirtman, Bernard
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