Publications of Baptiste Demoulin
All genres
Journal Article (3)
2020
Journal Article
16 (7), pp. 4213 - 4225 (2020)
A New Benchmark Set for Excitation Energy of Charge Transfer States: Systematic Investigation of Coupled Cluster Type Methods. Journal of Chemical Theory and Computation 2019
Journal Article
150 (16), 164123 (2019)
A domain-based local pair natural orbital implementation of the equation of motion coupled cluster method for electron attached states. The Journal of Chemical Physics
Journal Article
15 (4), pp. 2265 - 2277 (2019)
Multilayer Approach to the IP-EOM-DLPNO-CCSD Method: Theory, Implementation, and Application. Journal of Chemical Theory and Computation