Lista de obras -

A comparative first-principles study of martensitic phase transformations in TiPd2 and TiPd intermetallics

artículo científico publicado en 2014

A family of ductile intermetallic compounds

artículo científico publicado en 2003

A parameter-free prediction of simulated crystal nucleation times in the Lennard-Jones system: from the steady-state nucleation to the transient time regime

artículo científico publicado en 2010

Absence of enhanced fluctuations as a first-order phase transition is approached: An exact transfer-matrix study

scientific article published on 01 April 1993

Analytic prediction of the exact thermodynamics of a first-order structural phase transition: A practical second-order self-consistent phonon theory

scientific article published on 01 October 1992

Atomic bond fluctuations and crossover to potential-energy-landscape-influenced regime in supercooled liquid

artículo científico publicado en 2008

Calculating accurate free energies of solids directly from simulations

artículo científico publicado en 1995

Exactly solvable heterophase fluctuations at a vibrational-entropy-driven first-order phase transition

scientific article published on 01 October 1990

Freezing point and solid-liquid interfacial free energy of Stockmayer dipolar fluids: a molecular dynamics simulation study

artículo científico publicado en 2013

Ginzburg-Landau-type multiphase field model for competing fcc and bcc nucleation

artículo científico publicado en 2011

Isotope effect on adsorbed quantum phases: diffusion of H2 and D2 in nanoporous carbon

artículo científico publicado en 2013

Melting line of aluminum from simulations of coexisting phases

scientific article published on 01 February 1994

Melting temperature of ice Ih calculated from coexisting solid-liquid phases

scientific article published on 01 July 2005

Microstructure-Dependent Gas Adsorption: Accurate Predictions of Methane Uptake in Nanoporous Carbons

artículo científico publicado en 2014

Phase Transition of H2 in Subnanometer Pores Observed at 75 K.

artículo científico publicado en 2017

Predictive multiphase evolution in Al-containing high-entropy alloys

artículo científico publicado en 2018

Quantitative parameter-free prediction of simulated crystal-nucleation times

artículo científico publicado en 2006

Relationship between structure and conductivity in liquid carbon

scientific article published on 01 August 1995

Size effects and stochastic behavior of nanoindentation pop in

scientific article published on 20 April 2011

The anisotropic hard-sphere crystal-melt interfacial free energy from fluctuations

artículo científico publicado en 2006

The influence of dispersion interactions on the hydrogen adsorption properties of expanded graphite

scientific article published on 03 October 2012

The melting lines of model silicon calculated from coexisting solid-liquid phases

artículo científico publicado en 2004

The origin of viscosity as seen through atomic level stress correlation function ⬇️

artículo científico publicado el 28 de enero de 2013

Tight-binding study of tilt grain boundaries in diamond

artículo científico publicado en 1996

Topological Defects: Origin of Nanopores and Enhanced Adsorption Performance in Nanoporous Carbon

artículo científico publicado en 2012

Vibrational entropy effects at a diffusionless first-order solid-to-solid transition

scientific article published on 01 March 1991

Viscosity, shear waves, and atomic-level stress-stress correlations.