Shideh Ahmadi

2 Questions 10 Answers 0 Followers

Questions related from Shideh Ahmadi

How can I calculate adsorption energy of CO on nanoclusters by Dmol3?

I want to calculate adsorption energy for CO and O2 on nanoclusters. Which properties in dmol3 can help to calculate adsorption energy?

05 May 2014 4,765 8 View

What is a good way to rerun the program in material studio?

I run a program with material studio and suddenly my computer restarted. Is there any way to rerun my program? Because my program takes too much time around two months.

09 September 2013 757 4 View