Propiedades estructurales, dinámicas y ópticas de materiales - GIC 21/183
Tecnalia
Derio, EspañaPublicaciones en colaboración con investigadoras/es de Tecnalia (18)
2021
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A dissolution model of alite coupling surface topography and ions transport under different hydrodynamics conditions at microscale
Cement and Concrete Research, Vol. 142
2018
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Benchmark of ReaxFF force field for subcritical and supercritical water
Journal of Chemical Physics, Vol. 148, Núm. 23
2015
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Effect of chemical environment on the dynamics of water confined in calcium silicate minerals: Natural and synthetic tobermorite
Langmuir, Vol. 31, Núm. 17, pp. 4964-4972
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Nanoporosity, Inclusion Chemistry, and Spin Crossover in Orthogonally Interlocked Two-Dimensional Metal-Organic Frameworks
Chemistry - A European Journal, Vol. 21, Núm. 34, pp. 12112-12120
2014
2012
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Do cement nanotubes exist?
Advanced Materials, Vol. 24, Núm. 24, pp. 3239-3245
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Ettringite strengthening at high pressures induced by the densification of the hydrogen bond network
Journal of Physical Chemistry C, Vol. 116, Núm. 30, pp. 16138-16143
2011
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A model for the C-A-S-H gel formed in alkali-activated slag cements
Journal of the European Ceramic Society, Vol. 31, Núm. 12, pp. 2043-2056
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Ferromagnetic end-to-end azides and tetrahedral cobalt: Unusual findings in the M-BPA-pseudohalide2 system
Crystal Growth and Design, Vol. 11, Núm. 4, pp. 1310-1317
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Supramolecular 2D structures in [M(NCS)2(bpe)2(H 2O)2] (M = Mn, Fe) systems connected by hydrogen bonds
Polyhedron, Vol. 30, Núm. 6, pp. 923-928
2010
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Nanotechnology and concrete concepts and approach
Transportation Research Record, pp. 127-129
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Structural, spectroscopic, and magnetic characterization of the coordination polymers [MII(NCS)2(bpe)2] ·3H2O·2C2H6SO [M = Co, Ni; Bpe = 1,2-Bis(4-pyridyl)ethylene]. Two Interpenetrated Porous Networks
Crystal Growth and Design
2009
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Aluminum incorporation to dreierketten silicate chains
Journal of Physical Chemistry B, Vol. 113, Núm. 9, pp. 2832-2839
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Elastic properties of the main species present in Portland cement pastes
Acta Materialia, Vol. 57, Núm. 5, pp. 1666-1674
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Structural, mechanical, and reactivity properties of tricalcium aluminate using first-principles calculations
Journal of the American Ceramic Society, Vol. 92, Núm. 4, pp. 897-902
2008
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A molecular dynamics study of the aluminosilicate chains structure in Al-rich calcium silicate hydrated (C-S-H) gels
Physica Status Solidi (A) Applications and Materials Science
2007
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Mechanical properties of crystalline calcium-silicate-hydrates: Comparison with cementitious C-S-H gels
Physica Status Solidi (A) Applications and Materials Science
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On the formation of cementitious C-S-H nanoparticles
Journal of Computer-Aided Materials Design