German Sastre
German Sastre
Research Scientist CSIC, Computational Solid State Chemistry
Verified email at - Homepage
Cited by
Cited by
Modeling of silicon substitution in SAPO-5 and SAPO-34 molecular sieves
G Sastre, DW Lewis, CRA Catlow
The Journal of Physical Chemistry B 101 (27), 5249-5262, 1997
Multifunctional hybrid organic− inorganic catalytic materials with a hierarchical system of well-defined micro-and mesopores
A Corma, U Díaz, T García, G Sastre, A Velty
Journal of the American Chemical Society 132 (42), 15011-15021, 2010
The confinement effect in zeolites
G Sastre, A Corma
Journal of Molecular Catalysis A: Chemical 305 (1-2), 3-7, 2009
Preferential Location of Ge Atoms in Polymorph C of Beta Zeolite (ITQ‐17) and Their Structure‐Directing Effect: A Computational, XRD, and NMR Spectroscopic Study
G Sastre, JA Vidal‐Moya, T Blasco, J Rius, JL Jordá, MT Navarro, F Rey, ...
Angewandte Chemie International Edition 41 (24), 4722-4726, 2002
Correlation between Brønsted acid strength and local structure in zeolites
N Katada, K Suzuki, T Noda, G Sastre, M Niwa
The Journal of Physical Chemistry C 113 (44), 19208-19217, 2009
Modular organic structure-directing agents for the synthesis of zeolites
R Simancas, D Dari, N Velamazan, MT Navarro, A Cantín, JL Jorda, ...
Science 330 (6008), 1219-1222, 2010
Structure and stability of silica species in SAPO molecular sieves
G Sastre, DW Lewis, CRA Catlow
The Journal of Physical Chemistry 100 (16), 6722-6730, 1996
A zeolitic structure (ITQ-34) with connected 9-and 10-ring channels obtained with phosphonium cations as structure directing agents
A Corma, MJ Diaz-Cabanas, JL Jorda, F Rey, G Sastre, KG Strohmaier
Journal of the American Chemical Society 130 (49), 16482-16483, 2008
Xylene isomerization and aromatic alkylation in zeolites NU-87, SSZ-33, β, and ZSM-5: molecular dynamics and catalytic studies
FJ Llopis, G Sastre, A Corma
Journal of Catalysis 227 (1), 227-241, 2004
A Multisite Molecular Mechanism for Baeyer–Villiger Oxidations on Solid Catalysts Using Environmentally Friendly H2O2 as Oxidant
M Boronat, A Corma, M Renz, G Sastre, PM Viruela
Chemistry–A European Journal 11 (23), 6905-6915, 2005
Diffusion of benzene and propylene in MCM-22 zeolite. A molecular dynamics study
G Sastre, CRA Catlow, A Corma
The Journal of Physical Chemistry B 103 (25), 5187-5196, 1999
On the mechanism of alkane isomerisation (isodewaxing) with unidirectional 10-member ring zeolites. A molecular dynamics and catalytic study
G Sastre, A Chica, A Corma
Journal of catalysis 195 (2), 227-236, 2000
On the preferential location of Al and proton siting in zeolites: a computational and infrared study
G Sastre, V Fornes, A Corma
The Journal of Physical Chemistry B 106 (3), 701-708, 2002
Catalytic activity of proton sponge: Application to Knoevenagel condensation reactions
I Rodriguez, G Sastre, A Corma, S Iborra
Journal of Catalysis 183 (1), 14-23, 1999
Dielectric relaxation processes, electronic structure, and band gap engineering of MFU‐4‐type metal‐organic frameworks: Towards a rational design of semiconducting microporous …
P Sippel, D Denysenko, A Loidl, P Lunkenheimer, G Sastre, D Volkmer
Advanced Functional Materials 24 (25), 3885-3896, 2014
Light olefin diffusion during the MTO process on H-SAPO-34: A complex interplay of molecular factors
P Cnudde, R Demuynck, S Vandenbrande, M Waroquier, G Sastre, ...
Journal of the American Chemical Society 142 (13), 6007-6017, 2020
Effect of the germanium incorporation in the synthesis of EU-1, ITQ-13, ITQ-22, and ITQ-24 zeolites
G Sastre, A Pulido, R Castañeda, A Corma
The Journal of Physical Chemistry B 108 (26), 8830-8835, 2004
Computational and experimental approach to the role of structure-directing agents in the synthesis of zeolites: The case of cyclohexyl alkyl pyrrolidinium salts in the …
G Sastre, S Leiva, MJ Sabater, I Gimenez, F Rey, S Valencia, A Corma
The Journal of Physical Chemistry B 107 (23), 5432-5440, 2003
Connecting theory and simulation with experiment for the study of diffusion in nanoporous solids
BC Bukowski, FJ Keil, PI Ravikovitch, G Sastre, RQ Snurr, MO Coppens
Adsorption 27, 683-760, 2021
Modelling of Brønsted acidity in AFI and CHA zeotypes
G Sastre, DW Lewis
Journal of the Chemical Society, Faraday Transactions 94 (19), 3049-3058, 1998
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