Orca simulation ...

• Main Author: Rzepa, Henry S
• Format: Article in Journal/Newspaper
• Language: English
• Published: Imperial College London 2009
• Subjects: InChI=1/C7H5ClO3/c8-796-1-2-10-3-4-11-5-6/h1-5H/b2-1-,4-3-,6-5+; InChIKey=NTEKBRKOSBKKOY-LUMWGQSVBT; o1cccC=OClcocc1; Orca
• Online Access: https://dx.doi.org/10.14469/ch/2065; https://spectradspace.lib.imperial.ac.uk:8443/dspace/handle/10042/to-2090

octaphyrins ... : CUWWIA RI-B2GP-B2PLYP TZVPP TZVPP/C Opt ...