DFT and TD-DFT theoretical studies on photo-induced electron transfer process on [Cefamandole].C60 nano-complex

出版年份 2017 全文链接

标题

作者

关键词

Cefamandole antibiotic, C, 60, fullerene, Photoinduced electron transfer, Electron localization function, Reduced density gradient, NBO, Electron hole theory, TD-DFT method, Molecular modeling

出版物

JOURNAL OF MOLECULAR GRAPHICS & MODELLING

Volume 75, Issue -, Pages 42-48

出版商

Elsevier BV

发表日期

2017-04-28

DOI

10.1016/j.jmgm.2017.04.011

向作者/读者发起求助以获取更多资源

Protocol

在线求助

Reagent

在线求助

Reprint

联系作者

Discover Peeref hubs

Discuss science. Find collaborators. Network.

Join a conversation

Create your own webinar

Interested in hosting your own webinar? Check the schedule and propose your idea to the Peeref Content Team.

Create Now