the GW energy band gap
Posted: Wed May 30, 2018 7:46 pm
Hello,
For calculating the quasi-particle energy band gap in GW approximation, I used As.psp8(with 15) and In.psp8(with 13) with tgw1_9.in input file attached. But, I couldn't reach the energy band gap. What is wrong wit that?
Thank you,
For calculating the quasi-particle energy band gap in GW approximation, I used As.psp8(with 15) and In.psp8(with 13) with tgw1_9.in input file attached. But, I couldn't reach the energy band gap. What is wrong wit that?
Thank you,