Orca simulation ...

• Main Author: Mason, Nicholas
• Format: Article in Journal/Newspaper
• Language: unknown
• Published: Imperial College London 2013
• Subjects: InChI=1S/C11H17NO2.C7H6O/c13-111410-7-4-8-12109-5-2-1-3-6-9;8-6-7-4-2-1-3-5-7/h5,10H,1-4,6-8H2,H,13,14;1-6H/t10-;/m0./s1; KQPDMUAGXCXOOH-PPHPATTJSA-N; Orca
• Online Access: https://dx.doi.org/10.14469/ch/18735; https://spectradspace.lib.imperial.ac.uk:8443/dspace/handle/10042/24774

ORCA 6-31g(d) counterpoise correction ... : anti -R 6-31G(d) D3 ...