Title : Direct dynamics trajectory study of vibrational effects: can polanyi rules be generalized to a polyatomic system?

Pub. Date : 2004 Jul 21

PMID : 15250683






1 Functional Relationships(s)
Download
Sentence
Compound Name
Protein Name
Organism
1 We present an ab initio direct dynamics trajectory study of the hydrogen abstraction reaction: H2CO+ + CD4 --> H2COD+ + CD3, with methane excited in two different distortion modes (nu4 and nu2). Methane CD4 molecule Homo sapiens