[发布日期] [发布机构] Laboratory for Physical Chemistry, ETH Zurich, Vladimir-Prelog-Weg 2, Zurich; CH-8093, Switzerland^1;Center for Free-Electron Laser Science, DESY, Notkestrasse 85, Hamburg; 22607, Germany^2;ITAMP, Harvard-Smithsonian Center for Astrophysics, 60 Garden Street, Cambridge; MA; 02138, United States^3
[效力级别] [学科分类]
[关键词] Configuration interaction singles;Electronic ground state;Final state;Spin orbits;State of the art;Time dependent [时效性]