Molecular dynamics studies of impulse driven reactions in molecules and molecular clusters

We have used molecular dynamics methods to study collisions between atoms and molecules or molecular clusters. We find that these collisions may yield highly reactive molecular fragments and efficient intracluster covalent bond-forming reactions in the cluster. There is a good agreement between our...

ver descrição completa

Detalhes bibliográficos
Autores: Gatchell, Michael, Delaunay, Rudy, Stockett, Mark H., Patrick, Patrick, Domaracka, Alicja, Wang, Y., Chen, Tingyu, Adoui, Lamri, Alcamí Pertejo, Manuel, Martín García, Fernando, Schmidt, Henning T., Hubert, B.A., Cederquist, H.
Formato: artículo
Fecha de publicación:2015
País:España
Recursos:Universidad Autónoma de Madrid
Repositorio:Biblos-e Archivo. Repositorio Institucional de la UAM
Idioma:inglés
OAI Identifier:oai:repositorio.uam.es:10486/672441
Acesso em linha:http://hdl.handle.net/10486/672441
https://dx.doi.org/10.1088/1742-6596/635/3/032043
Access Level:acceso abierto
Palavra-chave:Atoms
Condensed matter physics
Molecules
Reaction kinetics
Química
Descrição
Resumo:We have used molecular dynamics methods to study collisions between atoms and molecules or molecular clusters. We find that these collisions may yield highly reactive molecular fragments and efficient intracluster covalent bond-forming reactions in the cluster. There is a good agreement between our simulations and various experimental results

Registos relacionados