Dear all, Recently, I have come across a thesis by Dr. Mikko Hakala, where it is mentioned that HSE is implemented in SIESTA. May I know, how to use it within siesta-3.2 (or any other version) for the energy/optimization calculations.
Thanking for your help, Sincerely, Sharma. ******************************************************** *Chaitanya Sharma,* *Prof. Pati'*s group, Chemistry and Physics Materials unit, JNCASR, BANGLORE, Lab:: (080-2208) 2581, 2809 https://sites.google.com/site/sharmasrkcyamijala/ *********************************************************