Ali Shahzad

3 Questions 3 Answers 0 Followers

Questions related from Ali Shahzad

Inquiry on INCAR Setup for vdW-Heterostructure Work Function Calculation?

Respected Seniors, I am working on calculating the work function for a van der Waals heterostructure and wanted to confirm if I should include the LUSE_VDW = .TRUE. tag in the INCAR file. Could...

01 November 2024 5,814 0 View

How we can find thermoelectric properties of 2D by VASP?

Hello Seniors, I need some help, I want to find out thermoelectric properties of 2D materials by VASP software can you tell me All steps and important INCAR tags.?

03 June 2024 7,163 1 View

VASP: Which properties I need to find first and then other order.....?

Hello seniors Im new, I want to make calculations of Electronic, magnetic, optical and thermoelectric properties 2D materials by VASP. please help me. Which properties I need to find first and...

27 September 2023 4,546 5 View