Alireza Lashkaripour

3 Questions 7 Answers 0 Followers

Questions related from Alireza Lashkaripour

How to perform LC-BLYP calculation with GAMESS?

Hello Dears, I am currently working on time-dependent density functional theory (TDDFT) calculations for both singlet and triplet states using the LC-BLYP functional in GAMESS. I believe I have...

02 May 2024 4,552 0 View

How to calculate exfoliation energy for a 2D material with Materials Studio?

Hi! I have built a CuTe2X 2D material and I want to calculate its exfoliation energy using Materials Studio, If you have any experience, please share it. Best Regards -Alireza

17 October 2022 3,715 0 View

Job Alert! /Ph.D. Candidates/Postdoc/Research Professor for MRSF-TDDFT

TITLE: Next Gen. Quantum Theory Developments for Photodynamic Simulations TOPICS: Improvements of MRSF-TDDFT and Nonadiabatic Dynamics Simulations on Photo-biology DESCRIPTION: Ph.D. Candidates...

01 January 1970 7,022 0 View