change EF_broadening to EF_integral_range

quanshengwu · May 20, 2024 · e7d0939 · e7d0939
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diff --git a/examples/Cu/AMR-xy/xyplane.sh b/examples/Cu/AMR-xy/xyplane.sh
@@ -34,7 +34,7 @@ NumOccupied = 6        ! set it anyway even don't use it.
 OmegaNum = 1        ! omega number
 OmegaMin = 0     ! energy interval
 OmegaMax = 0     ! energy interval E_i= OmegaMin+ (OmegaMax-OmegaMin)/(OmegaNum-1)*(i-1)
-EF_broadening = 0.05  ! in eV, a broadening factor to choose the k points for integration
+EF_integral_range = 0.05  ! in eV, a broadening factor to choose the k points for integration
 Nk1 =81            ! Kmesh(1) for KCUBE_BULK
 Nk2 =81            ! Kmesh(2) for KCUBE_BULK
 Nk3 =81            ! Kmesh(3) for KCUBE_BULK

diff --git a/examples/Cu/Readme.txt b/examples/Cu/Readme.txt
@@ -1,5 +1,7 @@
 # Added on Sep.05.2019 By QuanSheng Wu
 This is a example for calculating ordinary magnetoresistance with given magnetic field direction.
+0. unzip the hr.dat.tar.gz
+   $ tar xzvf wannier90_hr.dat_nsymm48.tar.gz
 1. Calculate band structure and Fermi surface
    $ cp wt.in-bands wt.in
    $ mpiexec -np 4 wt.x&

diff --git a/examples/Cu/wt.in-OHE-theta0 b/examples/Cu/wt.in-OHE-theta0
@@ -19,7 +19,7 @@ NumOccupied = 6        ! set it anyway even don't use it.
 OmegaNum = 3        ! omega number       
 OmegaMin = -0.01     ! energy interval
 OmegaMax =  0.01     ! energy interval E_i= OmegaMin+ (OmegaMax-OmegaMin)/(OmegaNum-1)*(i-1)
-EF_broadening = 0.15  ! in eV, a broadening factor to choose the k points for integration
+EF_integral_range = 0.15  ! in eV, a broadening factor to choose the k points for integration
 Nk1 =41            ! Kmesh(1) for KCUBE_BULK
 Nk2 =41            ! Kmesh(2) for KCUBE_BULK
 Nk3 =41            ! Kmesh(3) for KCUBE_BULK

diff --git a/examples/Cu/wt.in-OHE-theta18 b/examples/Cu/wt.in-OHE-theta18
@@ -19,7 +19,7 @@ NumOccupied = 6        ! set it anyway even don't use it.
 OmegaNum = 1        ! omega number       
 OmegaMin = 0     ! energy interval
 OmegaMax = 0     ! energy interval E_i= OmegaMin+ (OmegaMax-OmegaMin)/(OmegaNum-1)*(i-1)
-EF_broadening = 0.15
+EF_integral_range = 0.15
 Nk1 =41            ! Kmesh(1) for KCUBE_BULK
 Nk2 =41            ! Kmesh(2) for KCUBE_BULK
 Nk3 =41            ! Kmesh(3) for KCUBE_BULK

diff --git a/examples/Cu/wt.in-OHE-theta30 b/examples/Cu/wt.in-OHE-theta30
@@ -22,7 +22,7 @@ OmegaMax = 0     ! energy interval E_i= OmegaMin+ (OmegaMax-OmegaMin)/(OmegaNum-
 Nk1 =41            ! Kmesh(1) for KCUBE_BULK
 Nk2 =41            ! Kmesh(2) for KCUBE_BULK
 Nk3 =41            ! Kmesh(3) for KCUBE_BULK
-EF_broadening = 0.15
+EF_integral_range = 0.15
 BTauNum= 100        ! Number of B*tau we calculate
 BTauMax = 40.0      ! The maximum B*tau, starting from Btau=0.
 Tmin = 30           ! Temperature in Kelvin

diff --git a/examples/Cu/wt.in-OHE-theta45 b/examples/Cu/wt.in-OHE-theta45
@@ -22,7 +22,7 @@ OmegaMax = 0     ! energy interval E_i= OmegaMin+ (OmegaMax-OmegaMin)/(OmegaNum-
 Nk1 =41            ! Kmesh(1) for KCUBE_BULK
 Nk2 =41            ! Kmesh(2) for KCUBE_BULK
 Nk3 =41            ! Kmesh(3) for KCUBE_BULK
-EF_broadening = 0.15
+EF_integral_range = 0.15
 BTauNum= 100        ! Number of B*tau we calculate
 BTauMax = 40.0      ! The maximum B*tau, starting from Btau=0.
 Tmin = 30           ! Temperature in Kelvin