1 Questions 2 Answers 0 Followers
Questions related from Sungwon Park
Hello, I am trying to calculate solvation energy of Li+ (and Na+) with ethylene carbonate (# 1 ~ 5). For the reference, I need to get energy of Li+ in vacuum. So, I changed NELECT to "0". After...
30 July 2020 8,746 1 View