Using Diffusion Maps to Analyze Reaction Dynamics for a Hydrogen Combustion Benchmark Dataset.

Ko, Taehee; Heindel, Joseph P; Guan, Xingyi; Head-Gordon, Teresa; Williams-Young, David B; Yang, Chao

Ko, Taehee; Heindel, Joseph P; Guan, Xingyi; Head-Gordon, Teresa; Williams-Young, David B; Yang, Chao.

Afiliación

Ko T; Department of Mathematics, Penn State University, University Park, Pennsylvania 16802, United States.
Heindel JP; Kenneth S. Pitzer Theory Center and Department of Chemistry, University of California, Berkeley, California 94720, United States.
Guan X; Chemical Sciences Division, Lawrence Berkeley National Laboratory, Berkeley, California 94720, United States.
Head-Gordon T; Kenneth S. Pitzer Theory Center and Department of Chemistry, University of California, Berkeley, California 94720, United States.
Williams-Young DB; Chemical Sciences Division, Lawrence Berkeley National Laboratory, Berkeley, California 94720, United States.
Yang C; Kenneth S. Pitzer Theory Center and Department of Chemistry, University of California, Berkeley, California 94720, United States.

J Chem Theory Comput ; 19(17): 5872-5885, 2023 Sep 12.

Article en En | MEDLINE | ID: mdl-37585272

Texto completo

Añadir a Mi BVS

Imprimir

XML

PubMed Links

Buscar en Google

Texto completo: 1 Colección: 01-internacional Base de datos: MEDLINE Tipo de estudio: Prognostic_studies Idioma: En Revista: J Chem Theory Comput Año: 2023 Tipo del documento: Article País de afiliación: Estados Unidos

Texto completo

Añadir a Mi BVS

Imprimir

XML

PubMed Links

Buscar en Google