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23 setembre 2010 |
Altres combustibles: l’hidrogen |
González GarcÃa-Conde, Antonio
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Analysis of cooperation and electron delocalization in intermolecular hydrogen bonds |
Guillaumes Domènech, Laia
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15 juny 2015 |
Analysis of cooperation and electron delocalization in intermolecular hydrogen bonds |
Guillaumes Domènech, Laia
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Assessment of biotic and abiotic graphite cathodes for hydrogen production in microbial electrolysis cells |
Batlle Vilanova, Pau
; Puig Broch, SebastiÃ
; González Olmos, Rafael
; Vilajeliu Pons, Anna
; Bañeras Vives, LluÃs
; Balaguer i Condom, Maria Dolors
; Colprim Galceran, Jesús
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16 gener 2014 |
Assessment of biotic and abiotic graphite cathodes for hydrogen production in microbial electrolysis cells |
Batlle Vilanova, Pau
; Puig Broch, SebastiÃ
; González Olmos, Rafael
; Vilajeliu Pons, Anna
; Bañeras Vives, LluÃs
; Balaguer i Condom, Maria Dolors
; Colprim Galceran, Jesús
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1999 |
Basis set superposition error-counterpoise corrected potential energy surfaces : application to hydrogen peroxide ... X (X=F-, Cl-, Br-, Li+, Na+) complexes |
Daza, Martha C.
; Dobado, J. A.
; Molina Molina, José
; Salvador Sedano, Pedro
; Duran i Portas, Miquel
; Villaveces, José Luis
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Basis set superposition error-counterpoise corrected potential energy surfaces : application to hydrogen peroxide ... X (X=F-, Cl-, Br-, Li+, Na+) complexes |
Daza, Martha C.
; Dobado, J. A.
; Molina Molina, José
; Salvador Sedano, Pedro
; Duran i Portas, Miquel
; Villaveces, José Luis
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B-DNA structure and stability: the role of hydrogen bonding, π-π Stacking interactions, twist-angle, and solvation |
Poater i Teixidor, Jordi
; Swart, Marcel
; Bickelhaupt, F. Matthias
; Fonseca Guerra, Célia
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B-DNA structure and stability: the role of hydrogen bonding, π-π Stacking interactions, twist-angle, and solvation |
Poater i Teixidor, Jordi
; Swart, Marcel
; Bickelhaupt, F. Matthias
; Fonseca Guerra, Célia
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1 juny 2018 |
B-DNA structure and stability: the role of hydrogen bonding, π-π Stacking interactions, twist-angle, and solvation |
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5 juny 2018 |
B-DNA structure and stability: the role of hydrogen bonding, π-π Stacking interactions, twist-angle, and solvation |
Poater i Teixidor, Jordi
; Swart, Marcel
; Bickelhaupt, F. Matthias
; Fonseca Guerra, Célia
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14 juliol 2014 |
B-DNA structure and stability: the role of hydrogen bonding, π-π Stacking interactions, twist-angle, and solvation |
Poater i Teixidor, Jordi
; Swart, Marcel
; Bickelhaupt, F. Matthias
; Fonseca Guerra, Célia
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Bifunctional (cyclopentadienone)iron-tricarbonyl complexes: Synthesis, computational studies and application in reductive amination |
Moulin, Solenne
; Dentel, Hélène
; Pagnoux-Ozherelyeva, Anastassiya
; Gaillard, Sylvain
; Poater Teixidor, Albert
; Cavallo, Luigi
; Lohier, Jean François
; Renaud, Jean Luc
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23 desembre 2013 |
Bifunctional (cyclopentadienone)iron-tricarbonyl complexes: Synthesis, computational studies and application in reductive amination |
Moulin, Solenne
; Dentel, Hélène
; Pagnoux-Ozherelyeva, Anastassiya
; Gaillard, Sylvain
; Poater Teixidor, Albert
; Cavallo, Luigi
; Lohier, Jean François
; Renaud, Jean Luc
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juliol 2023 |
Catà lisi predictiva per millorar la semihidrogenació |
López Vilchez, Àlex
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juny 2018 |
Catalitzadors Knölker de ferro per hidrogenació |
Viñas Panella, Eduard
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31 maig 2023 |
Characterization of a filament wound thin-ply composite for a cryogenic tank for liquid hydrogen |
Olsson, Robin
; Marklund, E.
; Merzkirch, M.
; Ramantani, D.
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A chemical Hamiltonian approach study of the basis set superposition error changes on electron densities and one- and two-center energy components |
Salvador Sedano, Pedro
; Duran i Portas, Miquel
; Fradera i Llinà s, Xavier
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2002 |
A chemical Hamiltonian approach study of the basis set superposition error changes on electron densities and one- and two-center energy components |
Salvador Sedano, Pedro
; Duran i Portas, Miquel
; Fradera i Llinà s, Xavier
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15 febrer 2020 |
A chemical Hamiltonian approach study of the basis set superposition error changes on electron densities and one- and two-center energy components |
Salvador Sedano, Pedro
; Duran i Portas, Miquel
; Fradera i Llinà s, Xavier
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2000 |
C-H···O H-bonded complexes: how does basis set superposition error change their potential-energy surfaces? |
Salvador Sedano, Pedro
; Simon i Rabasseda, SÃlvia
; Duran i Portas, Miquel
; Dannenberg, J. J.
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C-H···O H-bonded complexes: how does basis set superposition error change their potential-energy surfaces? |
Salvador Sedano, Pedro
; Simon i Rabasseda, SÃlvia
; Duran i Portas, Miquel
; Dannenberg, J. J.
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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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29 juliol 2014 |
Development of highly structured non-heme iron catalysts for selective C-H group oxidations |
Canta i Roldós, Mercè
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