2 Questions 8 Answers 0 Followers
Questions related from Anand Bharadvaja
To optimise CI4 using Gaussian 09 i need to know what should i write in route setion and molecule speccification as a test, any basis set would suffice the purpose
12 October 2017 7,193 6 View
Pl help me in understanding how to calculates excited states of a molecule. what should be written in % section, route section and title section.
18 June 2017 3,603 3 View
