Publications
Ultrahigh interlayer friction in multiwalled boron nitride nanotubes. Nat Mater. 13(7):688-693.
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2014. Assessing Polarizability Models for the Simulation of Low-Frequency Raman Spectra of Benzene. The Journal of Physical Chemistry B. 119(29):9345-9358.
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2015. Bottom-up model of adsorption and transport in multiscale porous media.. Phys Rev E Stat Nonlin Soft Matter Phys. 91(3):ArticleNumber:032133.
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2015. Capturing material toughness by molecular simulation: accounting for large yielding effects and limits. International Journal of Fracture. 194(2):149-167.
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2015. Casimir-Polder force between anisotropic nanoparticles and gently curved surfaces. Physical Review D. 92(2)
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2015. Is cement a glassy material? Euro-C Conference. COMPUTATIONAL MODELLING OF CONCRETE STRUCTURES, VOL 1:169-176.
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2015. Is cement a glassy material? Euro-C Conference. COMPUTATIONAL MODELLING OF CONCRETE STRUCTURES, VOL 1:169-176.
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2015. Creep of Bulk C-S-H: Insights from Molecular Dynamics Simulations. 10th International Conference on Mechanics and Physics of Creep, Shrinkage, and Durability of Concrete and Concrete StructuresCONCREEP 10. CONCREEP 10: MECHANICS AND PHYSICS OF CREEP, SHRINKAGE, AND DURABILITY OF CONCRETE AND CONCRETE STRUCTURES :511-516.
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2015. C-S-H across Length Scales: From Nano to Micron. 10th International Conference on Mechanics and Physics of Creep, Shrinkage, and Durability of Concrete and Concrete StructuresCONCREEP 10. CONCREEP 10: MECHANICS AND PHYSICS OF CREEP, SHRINKAGE, AND DURABILITY OF CONCRETE AND CONCRETE STRUCTURES :39-48.
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2015. Diffusion of Interlayer Cations in Swelling Clays as a Function of Water Content: Case of Montmorillonites Saturated with Alkali Cations. The Journal of Physical Chemistry C. 119(19):10370-10378.
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2015. Evolution of particle size distributions in crushable granular materials. 3rd International Symposium on Geomechanics from Micro to Macro. Geomechanics from Micro to Macro:275-280.
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2015. Fracture toughness of calcium–silicate–hydrate from molecular dynamics simulations. Journal of Non-Crystalline Solids. 419:58-64.
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2015. Interplay of curvature and temperature in the Casimir–Polder interaction. Journal of Physics: Condensed Matter. 27(21):214018.
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2015. Kinetic Simulations of Cement Creep: Mechanisms from Shear Deformations of Glasses. 10th International Conference on Mechanics and Physics of Creep, Shrinkage, and Durability of Concrete and Concrete StructuresCONCREEP 10. CONCREEP 10: MECHANICS AND PHYSICS OF CREEP, SHRINKAGE, AND DURABILITY OF CONCRETE AND CONCRETE STRUCTURES:555-564.
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2015. Micromechanical analysis of the surface erosion of a cohesive soil by means of a coupled LBM-DEM model. IV International Conference on Particle-based Methods (PARTICLES 2015). PARTICLE-BASED METHODS IV-FUNDAMENTALS AND APPLICATIONS:519-528.
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2015. Micromechanical analysis of the surface erosion of a cohesive soil by means of a coupled LBM-DEM model. IV International Conference on Particle-based Methods (PARTICLES 2015). PARTICLE-BASED METHODS IV-FUNDAMENTALS AND APPLICATIONS:519-528.
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2015. Micromechanical analysis of the surface erosion of a cohesive soil by means of a coupled LBM-DEM model. IV International Conference on Particle-based Methods (PARTICLES 2015). PARTICLE-BASED METHODS IV-FUNDAMENTALS AND APPLICATIONS:519-528.
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2015. Micromechanical analysis of the surface erosion of a cohesive soil by means of a coupled LBM-DEM model. IV International Conference on Particle-based Methods (PARTICLES 2015). PARTICLE-BASED METHODS IV-FUNDAMENTALS AND APPLICATIONS:519-528.
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2015. Native Morphology of Hydrated Spheroidal Halloysite Observed by Environmental Transmission Electron Microscopy. Clays and Clay Minerals. 63(5):368-377.
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2015. Native Morphology of Hydrated Spheroidal Halloysite Observed by Environmental Transmission Electron Microscopy. Clays and Clay Minerals. 63(5):368-377.
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2015. Optimized molecular reconstruction procedure combining hybrid reverse Monte Carlo and molecular dynamics. The Journal of Chemical Physics. 142(11):ArticleNumber:114112.
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2015. Optimized molecular reconstruction procedure combining hybrid reverse Monte Carlo and molecular dynamics. The Journal of Chemical Physics. 142(11):ArticleNumber:114112.
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2015. Organic–Clay Interfacial Chemical Bonds Probed by ab Initio Calculations. The Journal of Physical Chemistry C. 119(12):6511-6517.
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2015. Polarized Water Wires under Confinement in Chiral Channels. The Journal of Physical Chemistry B. 119(28):8707-8717.
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2015. Predicting Adsorption on Bare and Modified Silica Surfaces. The Journal of Physical Chemistry C. 119(11):6009-6017.
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2015.