Electric field applied band structure
Posted: Wed May 23, 2018 7:49 am
How to get electric field applied band structure in vasp and which INCAR tag control it?
I have done first geometry optimisation and scf calculation. Next take CHGCAR from scf and put in INCAR ICHRG = 11 LDIPOL = .TRUE. IDIPOL = 3 EFIELD = 0.3 eV/A but did not get desired result. What is the relation between eV/A and V/nm?
I have done first geometry optimisation and scf calculation. Next take CHGCAR from scf and put in INCAR ICHRG = 11 LDIPOL = .TRUE. IDIPOL = 3 EFIELD = 0.3 eV/A but did not get desired result. What is the relation between eV/A and V/nm?