Quantum, classical, and hybrid QM/MM calculations in solution: General implementation of the ddCOSMO linear scaling strategy

Document type :
Journal articles
Complete list of metadatas

https://hal.archives-ouvertes.fr/hal-01090954
Contributor : Benjamin Stamm <>
Submitted on : Thursday, December 4, 2014 - 2:00:09 PM
Last modification on : Wednesday, May 15, 2019 - 11:12:09 AM

Identifiers

Citation

Filippo Lipparini, Giovanni Scalmani, Louis Lagardère, Benjamin Stamm, Eric Cancès, et al.. Quantum, classical, and hybrid QM/MM calculations in solution: General implementation of the ddCOSMO linear scaling strategy. Journal of Chemical Physics, American Institute of Physics, 2014, 141 (18), pp.184108. ⟨10.1063/1.4901304⟩. ⟨hal-01090954⟩

Share

Metrics

Record views

706