quantum-espresso/test-suite/epw_trev/epw1.in

50 lines
718 B
Plaintext

--
&inputepw
prefix = 'sic'
amass(1) = 28.0855
amass(2) = 12.0107
outdir = './'
elph = .true.
epbwrite = .true.
epbread = .false.
epwwrite = .true.
epwread = .false.
vme = 'dipole'
nbndsub = 4
wannierize = .true.
num_iter = 300
iprint = 2
dis_win_max = 12
dis_froz_max= 7
proj(1) = 'Si:sp3'
iverbosity = 0
elecselfen = .true.
phonselfen = .true.
a2f = .true.
fsthick = 15 ! eV
temps = 2000 ! K
degaussw = 1.0 ! eV
dvscf_dir = './save'
nkf1 = 6
nkf2 = 6
nkf3 = 6
nqf1 = 6
nqf2 = 6
nqf3 = 6
nk1 = 3
nk2 = 3
nk3 = 3
nq1 = 3
nq2 = 3
nq3 = 3
/