[转载]Wyckoff position 各种晶格群的表格 hefan1414 http://www.cryst.ehu.es/cgi-bin/cryst/programs/nph-wp-list 下面是从其他网站转的,读过后,对wyckoff position 可以有大致的了解了。 Space G ...
[转载]从DOS图确定成键类型的一些讨论 dwd0826 J. Phys. Chem. B 2004, 108, 14477-14483, Oxygen Overlayers on Pd(111) Studied by Density Functional Theory 里面有这样两段话, The adsorbate-adsorbat ...