Filtros de búsqueda

Lista de obras de George Opletal

Ab Initio Comparison of Bonding Environments and Threshold Behavior in Ge(x)As10Se(90-x) and Ge(x)Sb10Se(90-x) Glass Models.

artículo científico publicado en 2015

Bonding trends within ternary isocoordinate chalcogenide glasses Ge(x)As(y)Se(1-x-y)

artículo científico publicado en 2013

Chiminey: Reliable Computing and Data Management Platform in the Cloud

Constructing ab initio models of ultra-thin Al–AlOx–Al barriers

Correlating anisotropy and disorder with the surface structure of platinum nanoparticles

Crystallization in suspensions of hard spheres: a Monte Carlo and molecular dynamics simulation study.

artículo científico publicado en 2011

Dynamic evolution of specific catalytic sites on Pt nanoparticles

scholarly article

From Process to Properties: Correlating Synthesis Conditions and Structural Disorder of Platinum Nanocatalysts

HRMC: Hybrid Reverse Monte Carlo method with silicon and carbon potentials

HRMC_1.1: Hybrid Reverse Monte Carlo method with silicon and carbon potentials

Hybrid approach for generating realistic amorphous carbon structure using metropolis and reverse Monte Carlo

Ideality versus Reality: Emergence of the Chui Icosahedron

Microstructure of an industrial char by diffraction techniques and Reverse Monte Carlo modelling

Modeling of structure and porosity in amorphous silicon systems using Monte Carlo methods.

artículo científico publicado en 2007

Modeling the crystallization of gold nanoclusters-the effect of the potential energy function

artículo científico publicado en 2009

Nanoinformatics, and the big challenges for the science of small things

scientific article published on 09 August 2019

On reverse Monte Carlo constraints and model reproduction

artículo científico publicado en 2017

PorosityPlus: characterisation of defective, nanoporous and amorphous materials

Precursor-mediated crystallization process in suspensions of hard spheres

scientific article published on 08 July 2010

Predicting structure/property relationships in multi-dimensional nanoparticle data using t-distributed stochastic neighbour embedding and machine learning

artículo científico publicado en 2019

Predicting the role of seed morphology in the evolution of anisotropic nanocatalysts

artículo científico publicado en 2017

Simulating facet-dependent aggregation and assembly of distributions of polyhedral nanoparticles

artículo científico publicado en 2020

Structural analysis of carbonaceous solids using an adapted reverse Monte Carlo algorithm

Structural modeling of Ge6.25As32.5Se61.25 using a combination of reverse Monte Carlo and Ab initio molecular dynamics

scientific article published on 19 June 2014

The pure and representative types of disordered platinum nanoparticles from machine learning

artículo científico publicado en 2020

The structure of disordered carbon solids studied using a hybrid reverse Monte Carlo algorithm

Vacancy induced formation of nanoporous silicon, carbon and silicon carbide

artículo científico publicado en 2019