Ab initio dynamics and photoionization mass spectrometry reveal ion-molecule pathways from ionized acetylene clusters to benzene cation.

Stein, Tamar; Bandyopadhyay, Biswajit; Troy, Tyler P; Fang, Yigang; Kostko, Oleg; Ahmed, Musahid; Head-Gordon, Martin

Stein, Tamar; Bandyopadhyay, Biswajit; Troy, Tyler P; Fang, Yigang; Kostko, Oleg; Ahmed, Musahid; Head-Gordon, Martin.

Afiliação

Stein T; Chemical Sciences Division, Lawrence Berkeley National Laboratory, Berkeley, CA 94720.
Bandyopadhyay B; Department of Chemistry, University of California, Berkeley, CA 94720.
Troy TP; Chemical Sciences Division, Lawrence Berkeley National Laboratory, Berkeley, CA 94720.
Fang Y; Chemical Sciences Division, Lawrence Berkeley National Laboratory, Berkeley, CA 94720.
Kostko O; Chemical Sciences Division, Lawrence Berkeley National Laboratory, Berkeley, CA 94720.
Ahmed M; Chemical Sciences Division, Lawrence Berkeley National Laboratory, Berkeley, CA 94720.
Head-Gordon M; Chemical Sciences Division, Lawrence Berkeley National Laboratory, Berkeley, CA 94720; mahmed@lbl.gov mhg@cchem.berkeley.edu.

Proc Natl Acad Sci U S A ; 114(21): E4125-E4133, 2017 05 23.

Article em En | MEDLINE | ID: mdl-28484019

Palavras-chave

ionmolecule reactions; molecular dynamics; photoionization mass spectrometry; polycyclic aromatic hydrocarbons; quantum chemistry

Texto completo

Adicionar na Minha BVS

Imprimir

XML

PubMed Links

Buscar no Google

Texto completo: 1 Coleções: 01-internacional Base de dados: MEDLINE Idioma: En Revista: Proc Natl Acad Sci U S A Ano de publicação: 2017 Tipo de documento: Article