Figure_1.tif (141.5 kB)
Figure 1
figure
posted on 2014-02-18, 02:50 authored by Anders S. Christensen, Casper SteinmannCasper Steinmann, Dmitri G. Fedorov, Jan H. Jensendenotes the frozen domain (green); denotes the polarizable domain (blue); denotes the active domain (red); denotes fragment , for which the MP2 energy and gradients are evaluated (yellow).