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...

Descripción completa

Detalles 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.
Tipo de recurso: artículo
Fecha de publicación:2015
País:España
Institución:Universidad Autónoma de Madrid
Repositorio:Biblos-e Archivo. Repositorio Institucional de la UAM
Idioma:inglés
OAI Identifier:oai:repositorio.uam.es:10486/672441
Acceso en línea:http://hdl.handle.net/10486/672441
https://dx.doi.org/10.1088/1742-6596/635/3/032043
Access Level:acceso abierto
Palabra clave:Atoms
Condensed matter physics
Molecules
Reaction kinetics
Química
Descripción
Sumario: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

Similares en LA Referencia