Accurate Prediction of Bond Dissociation Energies and Barrier Heights for High-Energy Caged Nitro and Nitroamino Compounds Using a Coupled Cluster Theory

Document Details

Document Type: Pub Defense Publication
Publication Date: Mar 28, 2019
Source ID: 10.1021/acs.jpca.9b01506

Entities

People

Claude Franklin Goldsmith
Vitaly G. Kiselev

Organizations

Brown University
Novosibirsk State University
Office of Naval Research
Russian Science Foundation