Centro de Nanociencia y Tecnologías Sostenibles (CNATS)
Centre de recherche
University of Guelph
Guelph, CanadáPublications en collaboration avec des chercheurs de University of Guelph (8)
2012
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Location of extra-framework Co 2+, Ni 2+, Cu 2+ and Zn 2+ cations in natural and dealuminated clinoptilolite
Microporous and Mesoporous Materials, Vol. 155, pp. 233-239
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Surprising role of the BDC organic ligand in the adsorption of CO 2 by MOF-5
Microporous and Mesoporous Materials, Vol. 163, pp. 186-191
2010
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Locating extra-framework cations in low-silica zeolites by a combinatorial approach of the direct space method and rietveld refinement: Application to Ni2+ and Co2+ enriched clinoptilolite
Journal of Physical Chemistry C, Vol. 114, Núm. 13, pp. 5964-5974
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Zeolitic polyoxometalates metal organic frameworks (Z-POMOF) with imidazole ligands and ɛ-Keggin ions as building blocks; computational evaluation of hypothetical polymorphs and a synthesis approach
Physical Chemistry Chemical Physics, Vol. 12, Núm. 30, pp. 8632-8639
2009
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Zeolitic imidazole frameworks: Structural and energetics trends compared with their zeolite analogues
CrystEngComm, Vol. 11, Núm. 11, pp. 2272-2276
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Zeolitic polyoxometalate-based metal-organic frameworks (Z-POMOFs): Computational evaluation of hypothetical polymorphs and the successful targeted synthesis of the redox-active Z-POMOF1
Journal of the American Chemical Society, Vol. 131, Núm. 44, pp. 16078-16087
2007
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Interplay of water, extra-framework cations and framework atoms in the structure of low-silica zeolites: The case of the natural zeolite Goosecreekite as studied by computer simulation
Physical Chemistry Chemical Physics, Vol. 9, Núm. 4, pp. 521-532
2005
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Approaching the structure of heavily defective ionic oxides through atomistic modeling
Physica Status Solidi C: Conferences