All data for H c fitted with the empirical formula51: and H ab between 4.2 F p ∝ (H/H irr) p(1 − H/H irr)q . (7) For H c, q was fixed at 2.0 to minimize fit ambiguity, and p was slightly lower than 0.5 for all tem- peratures due to the correlated c-axis defects...
配合物DFT计算2 Crystal structures,DFT calculations and biological activities of three mercury complexes from a pentadentate thioether ligand Yu Li a ,b ,Jing-An Zhang b ,⁎,Yi-Bo Wang b ,Mei Pan c ,⁎⁎,Cheng-Yong Su c a Department of Chemical Engineering,Guangdong Industry Technical ...