The use of molecular dynamics simulations with ab initio SCF calculations for the determination of the oxygen-17 quadrupole coupling constant in liquid water.

Details

Language :

English

ISSN :

00268976

Volume :

80

Issue :

5

Database :

Complementary Index

Journal :

Molecular Physics

Publication Type :

Academic Journal

Accession number :

75979748

Full Text :

https://doi.org/10.1080/00268979300102961