Commit 23ec63c1 authored by Oleksandr Motornyi's avatar Oleksandr Motornyi

OM

parent a74b3ec7
......@@ -43,15 +43,9 @@ TLDEPS= pwlibs
all : tldeps phcg.x
<<<<<<< HEAD
phcg.x : libphcg.a $(PWOBJS) $(QEMODS) $(LIBOBJS)
$(LD) $(LDFLAGS) -o phcg.x \
libphcg.a $(PWOBJS) $(QEMODS) $(LIBOBJS) $(QELIBS)
=======
phcg.x : phcg.o libphcg.a $(PWOBJS) $(QEMODS) $(LIBOBJS)
$(LD) $(LDFLAGS) -o [email protected] \
phcg.o libphcg.a $(PWOBJS) $(QEMODS) $(LIBOBJS) $(QELIBS)
>>>>>>> 0efe83d29ae4c5f0bd004403548617d997955670
- ( cd ../../bin ; ln -fs ../PHonon/Gamma/phcg.x . )
tldeps :
if test -n "$(TLDEPS)" ; then \
......
......@@ -783,10 +783,7 @@ vasp_xml_module.o : ../../Modules/noncol.o
vasp_xml_module.o : ../../Modules/paw_variables.o
vasp_xml_module.o : ../../Modules/qes_libs_module.o
vasp_xml_module.o : ../../Modules/qes_types_module.o
<<<<<<< HEAD
vasp_xml_module.o : ../../Modules/read_pseudo.o
=======
>>>>>>> 0efe83d29ae4c5f0bd004403548617d997955670
vasp_xml_module.o : ../../Modules/recvec.o
vasp_xml_module.o : ../../Modules/recvec_subs.o
vasp_xml_module.o : ../../Modules/uspp.o
......
......@@ -27,11 +27,7 @@
Comput. Phys. Commun. 209, 116 (2016)
<<<<<<< HEAD
Program EPW v.5.0.0 starts on 4Feb2019 at 17:28:16
=======
Program EPW v.5.1.0 starts on 25Mar2019 at 11:26:32
>>>>>>> 0efe83d29ae4c5f0bd004403548617d997955670
This program is part of the open-source Quantum ESPRESSO suite
for quantum simulation of materials; please cite
......@@ -120,11 +116,7 @@
Reading interatomic force constants
Read Z* and epsilon
<<<<<<< HEAD
IFC last -0.0026114
=======
IFC last -0.0026119
>>>>>>> 0efe83d29ae4c5f0bd004403548617d997955670
Norm of the difference between old and new effective charges: 0.0000000
Norm of the difference between old and new force-constants: 0.0000020
Imposed crystal ASR
......@@ -159,11 +151,7 @@
Number of ep-matrix elements per pool : 74088 ~= 578.81 Kb (@ 8 bytes/ DP)
<<<<<<< HEAD
Number of elements per core 12954
=======
Number of elements per core 12956
>>>>>>> 0efe83d29ae4c5f0bd004403548617d997955670
Average over degenerate eigenstates is performed
=======================================================================
......@@ -171,18 +159,6 @@
[K] [eV] [cm^-3] [h per cell] [cm^2/Vs]
=======================================================================
<<<<<<< HEAD
400.000 6.8619 0.10000E+14 -0.10477E-02 0.645429E-02 x-axis
0.604609E-02 y-axis
0.640811E-02 z-axis
0.630283E-02 avg
0.123986E-02 off-diag
500.000 7.0136 0.10000E+14 -0.85381E-03 0.369117E-01 x-axis
0.345039E-01 y-axis
0.366393E-01 z-axis
0.360183E-01 avg
0.689981E-02 off-diag
=======
400.000 6.8619 0.10000E+14 0.15569E-12 0.661782E-02 x-axis
0.646817E-02 y-axis
0.604498E-02 z-axis
......@@ -193,7 +169,6 @@
0.344973E-01 z-axis
0.364557E-01 avg
0.668127E-02 off-diag
>>>>>>> 0efe83d29ae4c5f0bd004403548617d997955670
===================================================================
Start solving iterative Boltzmann Transport Equation
......@@ -208,20 +183,6 @@
[K] [eV] [cm^-3] [h per cell] [cm^2/Vs]
=======================================================================
<<<<<<< HEAD
400.000 6.8619 0.10000E+14 -0.36873E-02 0.712541E-02 x-axis
0.645458E-02 y-axis
0.704945E-02 z-axis
0.687648E-02 avg
0.112611E-02 off-diag
500.000 7.0136 0.10000E+14 -0.30259E-02 0.409393E-01 x-axis
0.370176E-01 y-axis
0.404953E-01 z-axis
0.394841E-01 avg
0.635892E-02 off-diag
0.394841E-01 Err
=======
400.000 6.8619 0.10000E+14 0.31031E-12 0.744691E-02 x-axis
0.720537E-02 y-axis
0.652235E-02 z-axis
......@@ -234,7 +195,6 @@
0.662355E-02 off-diag
0.404763E-01 Err
>>>>>>> 0efe83d29ae4c5f0bd004403548617d997955670
Iteration number: 2
......@@ -244,20 +204,6 @@
[K] [eV] [cm^-3] [h per cell] [cm^2/Vs]
=======================================================================
<<<<<<< HEAD
400.000 6.8619 0.10000E+14 -0.63873E-02 0.731226E-02 x-axis
0.658337E-02 y-axis
0.722937E-02 z-axis
0.704167E-02 avg
0.114523E-02 off-diag
500.000 7.0136 0.10000E+14 -0.52318E-02 0.420729E-01 x-axis
0.378142E-01 y-axis
0.415886E-01 z-axis
0.404919E-01 avg
0.650415E-02 off-diag
0.100781E-02 Err
=======
400.000 6.8619 0.10000E+14 0.46470E-12 0.766468E-02 x-axis
0.740205E-02 y-axis
0.665937E-02 z-axis
......@@ -270,7 +216,6 @@
0.679623E-02 off-diag
0.110837E-02 Err
>>>>>>> 0efe83d29ae4c5f0bd004403548617d997955670
Iteration number: 3
......@@ -280,20 +225,6 @@
[K] [eV] [cm^-3] [h per cell] [cm^2/Vs]
=======================================================================
<<<<<<< HEAD
400.000 6.8619 0.10000E+14 -0.94420E-02 0.734367E-02 x-axis
0.660763E-02 y-axis
0.725976E-02 z-axis
0.707036E-02 avg
0.114800E-02 off-diag
500.000 7.0136 0.10000E+14 -0.77442E-02 0.422701E-01 x-axis
0.379682E-01 y-axis
0.417797E-01 z-axis
0.406727E-01 avg
0.652873E-02 off-diag
0.180780E-03 Err
=======
400.000 6.8619 0.10000E+14 0.61889E-12 0.770987E-02 x-axis
0.744399E-02 y-axis
0.669211E-02 z-axis
......@@ -306,7 +237,6 @@
0.687135E-02 off-diag
0.237433E-03 Err
>>>>>>> 0efe83d29ae4c5f0bd004403548617d997955670
Iteration number: 4
......@@ -316,20 +246,6 @@
[K] [eV] [cm^-3] [h per cell] [cm^2/Vs]
=======================================================================
<<<<<<< HEAD
400.000 6.8619 0.10000E+14 -0.12410E-01 0.735295E-02 x-axis
0.661568E-02 y-axis
0.726883E-02 z-axis
0.707915E-02 avg
0.115151E-02 off-diag
500.000 7.0136 0.10000E+14 -0.10176E-01 0.423299E-01 x-axis
0.380206E-01 y-axis
0.418382E-01 z-axis
0.407296E-01 avg
0.655320E-02 off-diag
0.569005E-04 Err
=======
400.000 6.8619 0.10000E+14 0.77307E-12 0.772017E-02 x-axis
0.745374E-02 y-axis
0.670031E-02 z-axis
......@@ -342,7 +258,6 @@
0.689645E-02 off-diag
0.602412E-04 Err
>>>>>>> 0efe83d29ae4c5f0bd004403548617d997955670
Iteration number: 5
......@@ -359,15 +274,6 @@
Electron-Phonon interpolation
<<<<<<< HEAD
ephwann : 0.23s CPU 0.24s WALL ( 1 calls)
HamW2B : 0.01s CPU 0.02s WALL ( 686 calls)
Total program execution
EPW : 0.23s CPU 0.24s WALL
=======
ephwann : 0.22s CPU 0.23s WALL ( 1 calls)
HamW2B : 0.02s CPU 0.02s WALL ( 686 calls)
......@@ -375,7 +281,6 @@
Total program execution
EPW : 0.22s CPU 0.23s WALL
>>>>>>> 0efe83d29ae4c5f0bd004403548617d997955670
Please consider citing:
......
......@@ -27,11 +27,7 @@
Comput. Phys. Commun. 209, 116 (2016)
<<<<<<< HEAD
Program EPW v.5.0.0 starts on 4Feb2019 at 17:23:44
=======
Program EPW v.5.1.0 starts on 25Mar2019 at 11:28:42
>>>>>>> 0efe83d29ae4c5f0bd004403548617d997955670
This program is part of the open-source Quantum ESPRESSO suite
for quantum simulation of materials; please cite
......@@ -120,11 +116,7 @@
Reading interatomic force constants
Read Z* and epsilon
<<<<<<< HEAD
IFC last -0.0026114
=======
IFC last -0.0026119
>>>>>>> 0efe83d29ae4c5f0bd004403548617d997955670
Norm of the difference between old and new effective charges: 0.0000000
Norm of the difference between old and new force-constants: 0.0000020
Imposed crystal ASR
......@@ -172,21 +164,6 @@
Temperature 400.000 K
Valence band maximum = 6.255486 eV
<<<<<<< HEAD
Conduction band minimum = 7.660800 eV
Mobility VB Fermi level 6.861901 eV
Valence band maximum = 6.255486 eV
Conduction band minimum = 7.660800 eV
Mobility CB Fermi level 7.030496 eV
Temperature 500.000 K
Valence band maximum = 6.255486 eV
Conduction band minimum = 7.660800 eV
Mobility VB Fermi level 7.013560 eV
Valence band maximum = 6.255486 eV
Conduction band minimum = 7.660800 eV
Mobility CB Fermi level 6.872903 eV
=======
Conduction band minimum = 7.660801 eV
Mobility VB Fermi level 6.861901 eV
Valence band maximum = 6.255486 eV
......@@ -200,7 +177,6 @@
Valence band maximum = 6.255486 eV
Conduction band minimum = 7.660801 eV
Mobility CB Fermi level 6.872904 eV
>>>>>>> 0efe83d29ae4c5f0bd004403548617d997955670
===================================================================
Scattering rate for IBTE
......@@ -224,11 +200,7 @@
epmatkqread automatically changed to .true. as all scattering have been computed.
<<<<<<< HEAD
Number of elements per core 1841
=======
Number of elements per core 1842
>>>>>>> 0efe83d29ae4c5f0bd004403548617d997955670
Symmetry mapping finished
Average over degenerate eigenstates is performed
......@@ -237,18 +209,6 @@
[K] [eV] [cm^-3] [e per cell] [cm^2/Vs]
=======================================================================
<<<<<<< HEAD
400.000 7.0305 0.10000E+14 0.13281E-13 0.503291E+02 x-axis
0.503291E+02 y-axis
0.503291E+02 z-axis
0.503291E+02 avg
0.270985E+01 off-diag
500.000 6.8729 0.10000E+14 -0.19960E-13 0.341852E+02 x-axis
0.341852E+02 y-axis
0.341852E+02 z-axis
0.341852E+02 avg
0.183953E+01 off-diag
=======
400.000 7.0305 0.10000E+14 0.22404E-27 0.503288E+02 x-axis
0.503288E+02 y-axis
0.503288E+02 z-axis
......@@ -259,35 +219,6 @@
0.341850E+02 z-axis
0.341850E+02 avg
0.183954E+01 off-diag
>>>>>>> 0efe83d29ae4c5f0bd004403548617d997955670
===================================================================
Start solving iterative Boltzmann Transport Equation
===================================================================
Iteration number: 1
=======================================================================
Temp Fermi Elec density Population SR Elec mobility
[K] [eV] [cm^-3] [e per cell] [cm^2/Vs]
=======================================================================
<<<<<<< HEAD
400.000 7.0305 0.10000E+14 -0.17764E-14 0.425063E+02 x-axis
0.425063E+02 y-axis
0.425064E+02 z-axis
0.425063E+02 avg
0.197415E+01 off-diag
500.000 6.8729 0.10000E+14 0.53291E-14 0.289431E+02 x-axis
0.289431E+02 y-axis
0.289431E+02 z-axis
0.289431E+02 avg
0.133852E+01 off-diag
0.425063E+02 Err
=======
400.000 7.0305 0.10000E+14 -0.10588E-21 0.425064E+02 x-axis
0.425064E+02 y-axis
0.425065E+02 z-axis
......@@ -300,7 +231,6 @@
0.133852E+01 off-diag
0.425064E+02 Err
>>>>>>> 0efe83d29ae4c5f0bd004403548617d997955670
Iteration number: 2
......@@ -310,18 +240,6 @@
[K] [eV] [cm^-3] [e per cell] [cm^2/Vs]
=======================================================================
<<<<<<< HEAD
400.000 7.0305 0.10000E+14 0.10658E-13 0.437672E+02 x-axis
0.437673E+02 y-axis
0.437673E+02 z-axis
0.437673E+02 avg
0.212747E+01 off-diag
500.000 6.8729 0.10000E+14 -0.24869E-13 0.297792E+02 x-axis
0.297793E+02 y-axis
0.297793E+02 z-axis
0.297793E+02 avg
0.144186E+01 off-diag
=======
400.000 7.0305 0.10000E+14 -0.21176E-21 0.437673E+02 x-axis
0.437673E+02 y-axis
0.437673E+02 z-axis
......@@ -332,7 +250,6 @@
0.297793E+02 z-axis
0.297793E+02 avg
0.144185E+01 off-diag
>>>>>>> 0efe83d29ae4c5f0bd004403548617d997955670
0.126088E+01 Err
......@@ -344,18 +261,6 @@
[K] [eV] [cm^-3] [e per cell] [cm^2/Vs]
=======================================================================
<<<<<<< HEAD
400.000 7.0305 0.10000E+14 0.17764E-14 0.435590E+02 x-axis
0.435590E+02 y-axis
0.435591E+02 z-axis
0.435590E+02 avg
0.209845E+01 off-diag
500.000 6.8729 0.10000E+14 -0.88818E-15 0.296424E+02 x-axis
0.296424E+02 y-axis
0.296425E+02 z-axis
0.296424E+02 avg
0.142254E+01 off-diag
=======
400.000 7.0305 0.10000E+14 -0.18529E-21 0.435590E+02 x-axis
0.435591E+02 y-axis
0.435591E+02 z-axis
......@@ -366,7 +271,6 @@
0.296425E+02 z-axis
0.296425E+02 avg
0.142253E+01 off-diag
>>>>>>> 0efe83d29ae4c5f0bd004403548617d997955670
0.208206E+00 Err
......@@ -385,18 +289,6 @@
Electron-Phonon interpolation
<<<<<<< HEAD
ephwann : 2.49s CPU 3.65s WALL ( 1 calls)
ep-interp : 2.31s CPU 3.46s WALL ( 343 calls)
DynW2B : 0.01s CPU 0.01s WALL ( 343 calls)
HamW2B : 0.26s CPU 0.32s WALL ( 13780 calls)
ephW2Bp : 0.92s CPU 1.87s WALL ( 343 calls)
Total program execution
EPW : 2.49s CPU 3.65s WALL
=======
ephwann : 2.42s CPU 3.56s WALL ( 1 calls)
ep-interp : 2.24s CPU 3.37s WALL ( 343 calls)
......@@ -407,7 +299,6 @@
Total program execution
EPW : 2.42s CPU 3.56s WALL
>>>>>>> 0efe83d29ae4c5f0bd004403548617d997955670
Please consider citing:
......
......@@ -27,11 +27,7 @@
Comput. Phys. Commun. 209, 116 (2016)
<<<<<<< HEAD
Program EPW v.5.0.0 starts on 4Feb2019 at 17:23:48
=======
Program EPW v.5.1.0 starts on 25Mar2019 at 11:28:46
>>>>>>> 0efe83d29ae4c5f0bd004403548617d997955670
This program is part of the open-source Quantum ESPRESSO suite
for quantum simulation of materials; please cite
......@@ -120,11 +116,7 @@
Reading interatomic force constants
Read Z* and epsilon
<<<<<<< HEAD
IFC last -0.0026114
=======
IFC last -0.0026119
>>>>>>> 0efe83d29ae4c5f0bd004403548617d997955670
Norm of the difference between old and new effective charges: 0.0000000
Norm of the difference between old and new force-constants: 0.0000020
Imposed crystal ASR
......@@ -168,18 +160,6 @@
[K] [eV] [cm^-3] [h per cell] [cm^2/Vs]
=======================================================================
<<<<<<< HEAD
400.000 6.8619 0.10000E+14 -0.37838E-05 0.478644E-02 x-axis
0.115236E-01 y-axis
0.478645E-02 z-axis
0.703217E-02 avg
0.157115E-04 off-diag
500.000 7.0136 0.10000E+14 -0.32700E-05 0.274751E-01 x-axis
0.637035E-01 y-axis
0.274751E-01 z-axis
0.395512E-01 avg
0.100271E-03 off-diag
=======
400.000 6.8619 0.10000E+14 0.15630E-12 0.478648E-02 x-axis
0.115237E-01 y-axis
0.478647E-02 z-axis
......@@ -190,7 +170,6 @@
0.274752E-01 z-axis
0.395515E-01 avg
0.100270E-03 off-diag
>>>>>>> 0efe83d29ae4c5f0bd004403548617d997955670
===================================================================
Start solving iterative Boltzmann Transport Equation
......@@ -205,20 +184,6 @@
[K] [eV] [cm^-3] [h per cell] [cm^2/Vs]
=======================================================================
<<<<<<< HEAD
400.000 6.8619 0.10000E+14 -0.75702E-05 0.613183E-02 x-axis
0.101815E-01 y-axis
0.613185E-02 z-axis
0.748171E-02 avg
0.462857E-04 off-diag
500.000 7.0136 0.10000E+14 -0.65421E-05 0.352955E-01 x-axis
0.566236E-01 y-axis
0.352956E-01 z-axis
0.424049E-01 avg
0.290986E-03 off-diag
0.424049E-01 Err
=======
400.000 6.8619 0.10000E+14 0.31258E-12 0.576100E-02 x-axis
0.123360E-01 y-axis
0.576100E-02 z-axis
......@@ -231,7 +196,6 @@
0.562277E-03 off-diag
0.448944E-01 Err
>>>>>>> 0efe83d29ae4c5f0bd004403548617d997955670
Iteration number: 2
......@@ -241,20 +205,6 @@
[K] [eV] [cm^-3] [h per cell] [cm^2/Vs]
=======================================================================
<<<<<<< HEAD
400.000 6.8619 0.10000E+14 -0.11357E-04 0.661586E-02 x-axis
0.103562E-01 y-axis
0.661588E-02 z-axis
0.786265E-02 avg
0.478162E-04 off-diag
500.000 7.0136 0.10000E+14 -0.98144E-05 0.381083E-01 x-axis
0.576816E-01 y-axis
0.381084E-01 z-axis
0.446328E-01 avg
0.301483E-03 off-diag
0.222789E-02 Err
=======
400.000 6.8619 0.10000E+14 0.46885E-12 0.626663E-02 x-axis
0.125619E-01 y-axis
0.626663E-02 z-axis
......@@ -267,7 +217,6 @@
0.752440E-03 off-diag
0.243506E-02 Err
>>>>>>> 0efe83d29ae4c5f0bd004403548617d997955670
Iteration number: 3
......@@ -277,20 +226,6 @@
[K] [eV] [cm^-3] [h per cell] [cm^2/Vs]
=======================================================================
<<<<<<< HEAD
400.000 6.8619 0.10000E+14 -0.15144E-04 0.677192E-02 x-axis
0.103508E-01 y-axis
0.677194E-02 z-axis
0.796489E-02 avg
0.484122E-04 off-diag
500.000 7.0136 0.10000E+14 -0.13086E-04 0.390317E-01 x-axis
0.576726E-01 y-axis
0.390318E-01 z-axis
0.452454E-01 avg
0.304995E-03 off-diag
0.612607E-03 Err
=======
400.000 6.8619 0.10000E+14 0.62511E-12 0.641233E-02 x-axis
0.126295E-01 y-axis
0.641234E-02 z-axis
......@@ -303,7 +238,6 @@
0.791766E-03 off-diag
0.708655E-03 Err
>>>>>>> 0efe83d29ae4c5f0bd004403548617d997955670
Iteration number: 4
......@@ -313,20 +247,6 @@
[K] [eV] [cm^-3] [h per cell] [cm^2/Vs]
=======================================================================
<<<<<<< HEAD
400.000 6.8619 0.10000E+14 -0.18930E-04 0.682645E-02 x-axis
0.103546E-01 y-axis
0.682647E-02 z-axis
0.800252E-02 avg
0.483707E-04 off-diag
500.000 7.0136 0.10000E+14 -0.16358E-04 0.393568E-01 x-axis
0.577063E-01 y-axis
0.393569E-01 z-axis
0.454733E-01 avg
0.304725E-03 off-diag
0.227943E-03 Err
=======
400.000 6.8619 0.10000E+14 0.78135E-12 0.647268E-02 x-axis
0.126416E-01 y-axis
0.647268E-02 z-axis
......@@ -339,7 +259,6 @@
0.801456E-03 off-diag
0.268599E-03 Err
>>>>>>> 0efe83d29ae4c5f0bd004403548617d997955670
Iteration number: 5
......
......@@ -27,11 +27,7 @@
Comput. Phys. Commun. 209, 116 (2016)
<<<<<<< HEAD
Program EPW v.5.1.0 starts on 27Feb2019 at 17:58:10
=======
Program EPW v.5.1.0 starts on 25Mar2019 at 11:29:18
>>>>>>> 0efe83d29ae4c5f0bd004403548617d997955670
This program is part of the open-source Quantum ESPRESSO suite
for quantum simulation of materials; please cite
......@@ -202,20 +198,12 @@
[K] [eV] [cm^-3] [e per cell] [cm^2/Vs]
=======================================================================
<<<<<<< HEAD
400.000 7.0305 0.10000E+14 0.53291E-14 0.291052E+00 x-axis
=======
400.000 7.0305 0.10000E+14 0.16156E-26 0.291052E+00 x-axis
>>>>>>> 0efe83d29ae4c5f0bd004403548617d997955670
0.291048E+00 y-axis
0.291043E+00 z-axis
0.291048E+00 avg
-0.881377E-01 off-diag
<<<<<<< HEAD
500.000 6.8729 0.10000E+14 -0.36415E-13 0.226888E+00 x-axis
=======
500.000 6.8729 0.10000E+14 0.16156E-26 0.226888E+00 x-axis
>>>>>>> 0efe83d29ae4c5f0bd004403548617d997955670
0.226885E+00 y-axis
0.226882E+00 z-axis
0.226885E+00 avg
......@@ -234,20 +222,6 @@
[K] [eV] [cm^-3] [e per cell] [cm^2/Vs]
=======================================================================
<<<<<<< HEAD
400.000 7.0305 0.10000E+14 -0.35527E-14 0.247099E+00 x-axis
0.247095E+00 y-axis
0.247091E+00 z-axis
0.247095E+00 avg
-0.749662E-01 off-diag
500.000 6.8729 0.10000E+14 -0.26645E-14 0.194968E+00 x-axis
0.194965E+00 y-axis
0.194962E+00 z-axis
0.194965E+00 avg
-0.497501E-01 off-diag
0.247095E+00 Err
=======
400.000 7.0305 0.10000E+14 -0.29346E-27 0.247133E+00 x-axis
0.247129E+00 y-axis
0.247125E+00 z-axis
......@@ -260,7 +234,6 @@
-0.498150E-01 off-diag
0.247129E+00 Err
>>>>>>> 0efe83d29ae4c5f0bd004403548617d997955670
Iteration number: 2
......@@ -270,20 +243,6 @@
[K] [eV] [cm^-3] [e per cell] [cm^2/Vs]
=======================================================================
<<<<<<< HEAD
400.000 7.0305 0.10000E+14 -0.39968E-14 0.253805E+00 x-axis
0.253801E+00 y-axis
0.253796E+00 z-axis
0.253801E+00 avg
-0.769328E-01 off-diag
500.000 6.8729 0.10000E+14 0.12434E-13 0.199728E+00 x-axis
0.199725E+00 y-axis
0.199722E+00 z-axis
0.199725E+00 avg
-0.510597E-01 off-diag
0.670537E-02 Err
=======
400.000 7.0305 0.10000E+14 0.68158E-27 0.253832E+00 x-axis
0.253828E+00 y-axis
0.253824E+00 z-axis
......@@ -296,7 +255,6 @@
-0.511206E-01 off-diag
0.669890E-02 Err
>>>>>>> 0efe83d29ae4c5f0bd004403548617d997955670
Iteration number: 3
......@@ -306,20 +264,6 @@
[K] [eV] [cm^-3] [e per cell] [cm^2/Vs]
=======================================================================
<<<<<<< HEAD
400.000 7.0305 0.10000E+14 0.35527E-14 0.252777E+00 x-axis
0.252773E+00 y-axis
0.252769E+00 z-axis
0.252773E+00 avg
-0.766400E-01 off-diag
500.000 6.8729 0.10000E+14 0.21760E-13 0.199014E+00 x-axis
0.199011E+00 y-axis
0.199008E+00 z-axis
0.199011E+00 avg
-0.508637E-01 off-diag
0.102780E-02 Err
=======
400.000 7.0305 0.10000E+14 0.13127E-26 0.252806E+00 x-axis
0.252801E+00 y-axis
0.252797E+00 z-axis
......@@ -332,7 +276,6 @@
-0.509252E-01 off-diag
0.102669E-02 Err
>>>>>>> 0efe83d29ae4c5f0bd004403548617d997955670
Iteration number: 4
......@@ -349,18 +292,6 @@
Electron-Phonon interpolation
<<<<<<< HEAD
ephwann : 3.63s CPU 4.97s WALL ( 1 calls)
ep-interp : 3.44s CPU 4.78s WALL ( 343 calls)
DynW2B : 0.01s CPU 0.01s WALL ( 343 calls)
HamW2B : 0.28s CPU 0.32s WALL ( 13780 calls)
ephW2Bp : 0.81s CPU 1.91s WALL ( 343 calls)
Total program execution
EPW : 3.63s CPU 4.97s WALL
=======
ephwann : 3.68s CPU 4.81s WALL ( 1 calls)
ep-interp : 3.49s CPU 4.62s WALL ( 343 calls)
......@@ -371,7 +302,6 @@
Total program execution
EPW : 3.68s CPU 4.81s WALL
>>>>>>> 0efe83d29ae4c5f0bd004403548617d997955670
Please consider citing:
......
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