Structure and properties of nanoscale materials: theory and atomistic computer simulation
type: Dataset
contact point: Organization
  fn: CCSD
keyword: physphysics-physics
keyword: journal-articles
keyword: infoeu-reposemanticsarticle
landing page: 1475-7435
description: We present a review of a few research topics developed within the "Theory and Atomistic Computer Simulation" Department at CINaM. The bottom line of the scientific activity is to use up-to-date theoretical and computer simulation techniques to address physics and materials science problems, often at the nanometric scale, in close contact with experimental groups. It ranges from the study of the structure and properties of molecular systems for organic electronics to metallic clusters and alloys, magnetic oxides, nuclear fuels and carbon-based nanostructures. These studies are motivated by fundamental research questions as well as more applied goals including environmental and energy issues, or information technologies. This broad spectrum of activities requires a large range of techniques, from theory and ab initio calculations to semi-empirical models incorporated in Monte Carlo or molecular dynamics simulations. Copyright © 2012 Inderscience Enterprises Ltd.
issued: 2026-05-18T19:40:57.565886
language: en
modified: 2026-05-18T19:40:57.565891

test_moissonnage_selune
type: Agent

Structure and properties of nanoscale materials: theory and atomistic computer simulation
type: Distribution
access URL: https://hal.science/hal-00697530
format: HTML
issued: 2026-05-18T19:40:57.614370
modified: 2026-05-18T19:40:57.552606