which pseudopotentials?
Posted: Tue Oct 05, 2010 8:40 am
Hello
i am working by abinit,i have put job for calculation of polarization but i have problem with pseudopotential of bifeo3,i have written this part in my files:
../../../Psps_for_tests/83bi.pspnc
../../../Psps_for_tests/26fe.pspnc
../../../Psps_for_tests/8o.pspnc
please guide me how i can choes potention for my job?
thankyou.
i am working by abinit,i have put job for calculation of polarization but i have problem with pseudopotential of bifeo3,i have written this part in my files:
../../../Psps_for_tests/83bi.pspnc
../../../Psps_for_tests/26fe.pspnc
../../../Psps_for_tests/8o.pspnc
please guide me how i can choes potention for my job?
thankyou.