Dear all, I want to explain something in very chemical viewpoint. So HOMO and LUMO is very important. I am wondering whether we could plot HOMO, HOMO-1, HOMO-2 or LUMO etc for slab model in QE.
thank you for reading best, vega -- ================================================================================== Vega Lew ( weijia liu) Graduate students State Key Laboratory of Materials-oriented Chemical Engineering Nanjing University of Technology, 210009, Nanjing, Jiangsu, China *********************************************************************************************** Email: vegalew at gmail.com Office: Room A705, Technical Innovation Building, Xinmofan Road 5#, Nanjing, Jiangsu, China *********************************************************************************************** -------------- next part -------------- An HTML attachment was scrubbed... URL: http://www.democritos.it/pipermail/pw_forum/attachments/20100124/3ac3b16e/attachment.htm
