mirror of https://gitlab.com/QEF/q-e.git
4662 lines
262 KiB
Plaintext
4662 lines
262 KiB
Plaintext
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``:oss/
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`.+s+. .+ys--yh+ `./ss+.
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-sh//yy+` +yy +yy -+h+-oyy
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-yh- .oyy/.-sh. .syo-.:sy- /yh
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`.-.` `yh+ -oyyyo. `/syys: oys `.`
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`/+ssys+-` `sh+ ` oys` .:osyo`
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-yh- ./syyooyo` .sys+/oyo--yh/
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`yy+ .-:-. `-/+/:` -sh-
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/yh. oys
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``..---hho---------` .---------..` `.-----.` -hd+---.
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`./osmNMMMMMMMMMMMMMMMs. +NNMMMMMMMMNNmh+. yNMMMMMNm- oNMMMMMNmo++:`
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+sy--/sdMMMhyyyyyyyNMMh- .oyNMMmyyyyyhNMMm+` -yMMMdyyo:` .oyyNMMNhs+syy`
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-yy/ /MMM+.`-+/``mMMy- `mMMh:`````.dMMN:` `MMMy-`-dhhy```mMMy:``+hs
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-yy+` /MMMo:-mMM+`-oo/. mMMh: `dMMN/` dMMm:`dMMMMy..MMMo-.+yo`
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.sys`/MMMMNNMMMs- mMMmyooooymMMNo: oMMM/sMMMMMM++MMN//oh:
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`sh+/MMMhyyMMMs- `-` mMMMMMMMMMNmy+-` -MMMhMMMsmMMmdMMd/yy+
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`-/+++oyy-/MMM+.`/hh/.`mNm:` mMMd+/////:-.` NMMMMMd/:NMMMMMy:/yyo/:.`
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+os+//:-..-oMMMo:--:::-/MMMo. .-mMMd+---` hMMMMN+. oMMMMMo. `-+osyso:`
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syo `mNMMMMMNNNNNNNNMMMo.oNNMMMMMNNNN:` +MMMMs:` dMMMN/` ``:syo
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/yh` :syyyyyyyyyyyyyyyy+.`+syyyyyyyyo:` .oyys:` .oyys:` +yh
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-yh- ```````````````` ````````` `` `` oys
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-+h/------------------------::::::::://////++++++++++++++++++++++///////::::/yd:
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shdddddddddddddddddddddddddddddhhhhhhhhyyyyyssssssssssssssssyyyyyyyhhhhhhhddddh`
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S. Ponce, E. R. Margine, C. Verdi, and F. Giustino,
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Comput. Phys. Commun. 209, 116 (2016)
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Program EPW v.5.0.0 starts on 11Jan2019 at 12: 8:52
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This program is part of the open-source Quantum ESPRESSO suite
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for quantum simulation of materials; please cite
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"P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009);
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"P. Giannozzi et al., J. Phys.:Condens. Matter 29 465901 (2017);
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URL http://www.quantum-espresso.org",
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in publications or presentations arising from this work. More details at
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http://www.quantum-espresso.org/quote
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Parallel version (MPI), running on 1 processors
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MPI processes distributed on 1 nodes
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------------------------------------------------------------------------
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RESTART - RESTART - RESTART - RESTART
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Restart is done without reading PWSCF save file.
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Be aware that some consistency checks are therefore not done.
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------------------------------------------------------------------------
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--
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bravais-lattice index = 0
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lattice parameter (a_0) = 0.0000 a.u.
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unit-cell volume = 0.0000 (a.u.)^3
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number of atoms/cell = 0
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number of atomic types = 0
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kinetic-energy cut-off = 0.0000 Ry
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charge density cut-off = 0.0000 Ry
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Exchange-correlation = not set (-1 -1 -1 -1-1-1)
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celldm(1)= 0.00000 celldm(2)= 0.00000 celldm(3)= 0.00000
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celldm(4)= 0.00000 celldm(5)= 0.00000 celldm(6)= 0.00000
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crystal axes: (cart. coord. in units of a_0)
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a(1) = ( 0.0000 0.0000 0.0000 )
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a(2) = ( 0.0000 0.0000 0.0000 )
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a(3) = ( 0.0000 0.0000 0.0000 )
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reciprocal axes: (cart. coord. in units 2 pi/a_0)
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b(1) = ( 0.0000 0.0000 0.0000 )
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b(2) = ( 0.0000 0.0000 0.0000 )
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b(3) = ( 0.0000 0.0000 0.0000 )
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Atoms inside the unit cell:
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Cartesian axes
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site n. atom mass positions (a_0 units)
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No symmetry!
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G cutoff = 0.0000 ( 0 G-vectors) FFT grid: ( 0, 0, 0)
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number of k points= 0
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cart. coord. in units 2pi/a_0
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===========================================================================
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Performing the CUMULANT EXPANSION of the retarded Greens function to obtain
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the electron spectral function.
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There is no spin degeneracy factor, as in spectral_func.f90
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Warning: the routine is sequential but very fast.
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===========================================================================
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Read self-energy from file specfun_sup.elself
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Check: nk = 216, ibndmin = 1, ibndmax = 4 kbT (eV) = 0.025852
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k Energy [eV] A(k,w) [meV^-1] Z-factor
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with convolutions | using FFT
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1 -4.00000 0.1170381E-05 0.4371788E-04 0.9847
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1 -3.73680 0.1763028E-05 0.4538904E-04
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1 -3.47370 0.1742293E-05 0.4719706E-04
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1 -3.21050 0.1826479E-05 0.4924923E-04
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1 -2.94740 0.2394573E-05 0.5166348E-04
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1 -2.68420 0.2961745E-05 0.5458141E-04
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1 -2.42110 0.3478743E-05 0.5820893E-04
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1 -2.15790 0.4045895E-05 0.6286875E-04
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1 -1.89470 0.4845543E-05 0.6907671E-04
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1 -1.63160 0.6104232E-05 0.7768568E-04
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1 -1.36840 0.8179214E-05 0.9018838E-04
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1 -1.10530 0.1172420E-04 0.1093778E-03
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1 -0.84210 0.1820675E-04 0.1408349E-03
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1 -0.57890 0.3227924E-04 0.1962342E-03
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1 -0.31580 0.7189673E-04 0.2990600E-03
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1 -0.05260 0.2752746E-03 0.4772008E-03
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1 0.21050 0.4874226E-02 0.6452440E-03
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1 0.47370 0.2751776E-03 0.5581259E-03
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1 0.73680 0.7210963E-04 0.3592022E-03
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1 1.00000 0.3483500E-04 0.2284828E-03
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2 -4.00000 0.3846331E-05 0.4866793E-04 1.0046
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2 -3.73680 0.3791676E-05 0.5141049E-04
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2 -3.47370 0.4008236E-05 0.5457430E-04
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2 -3.21050 0.4385446E-05 0.5840447E-04
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2 -2.94740 0.5026432E-05 0.6323119E-04
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2 -2.68420 0.6249394E-05 0.6954181E-04
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2 -2.42110 0.8094905E-05 0.7814527E-04
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2 -2.15790 0.1094592E-04 0.9047883E-04
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2 -1.89470 0.1578207E-04 0.1092387E-03
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2 -1.63160 0.2450309E-04 0.1397905E-03
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2 -1.36840 0.4336869E-04 0.1933398E-03
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2 -1.10530 0.9621667E-04 0.2927056E-03
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2 -0.84210 0.3562199E-03 0.4679038E-03
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2 -0.57890 0.3760411E-02 0.6493116E-03
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2 -0.31580 0.3565722E-03 0.5818461E-03
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2 -0.05260 0.9628730E-04 0.3778715E-03
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2 0.21050 0.4334853E-04 0.2390762E-03
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2 0.47370 0.2442791E-04 0.1636397E-03
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2 0.73680 0.1566338E-04 0.1217011E-03
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2 1.00000 0.1088734E-04 0.9667903E-04
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3 -4.00000 0.1492309E-04 0.8043303E-04 1.0253
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3 -3.73680 0.1801938E-04 0.9535442E-04
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3 -3.47370 0.2414600E-04 0.1178514E-03
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3 -3.21050 0.3608110E-04 0.1548326E-03
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3 -2.94740 0.6283765E-04 0.2208820E-03
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3 -2.68420 0.1367784E-03 0.3441966E-03
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3 -2.42110 0.4730591E-03 0.5441138E-03
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3 -2.15790 0.2681943E-02 0.6684242E-03
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3 -1.89470 0.4730312E-03 0.5176005E-03
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3 -1.63160 0.1364483E-03 0.3242170E-03
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3 -1.36840 0.6237675E-04 0.2093627E-03
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3 -1.10530 0.3543153E-04 0.1477823E-03
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3 -0.84210 0.2277540E-04 0.1130480E-03
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3 -0.57890 0.1585470E-04 0.9189971E-04
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3 -0.31580 0.1166605E-04 0.7810080E-04
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3 -0.05260 0.8939643E-05 0.6859094E-04
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3 0.21050 0.7068450E-05 0.6175932E-04
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3 0.47370 0.5727808E-05 0.5669056E-04
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3 0.73680 0.4735215E-05 0.5282575E-04
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3 1.00000 0.3979419E-05 0.4980468E-04
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4 -4.00000 0.3977864E-04 0.1814214E-03 1.0439
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4 -3.73680 0.6837126E-04 0.2709283E-03
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4 -3.47370 0.1480039E-03 0.4334567E-03
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4 -3.21050 0.5027517E-03 0.6395102E-03
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4 -2.94740 0.2552014E-02 0.6355475E-03
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4 -2.68420 0.5024980E-03 0.4274779E-03
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4 -2.42110 0.1482631E-03 0.2666351E-03
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4 -2.15790 0.6839245E-04 0.1789955E-03
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4 -1.89470 0.3867792E-04 0.1314917E-03
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4 -1.63160 0.2485065E-04 0.1038366E-03
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4 -1.36840 0.1729992E-04 0.8644436E-04
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4 -1.10530 0.1273037E-04 0.7477698E-04
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4 -0.84210 0.9754555E-05 0.6654745E-04
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4 -0.57890 0.7709811E-05 0.6051487E-04
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4 -0.31580 0.6245233E-05 0.5596037E-04
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4 -0.05260 0.5160213E-05 0.5244344E-04
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4 0.21050 0.4337307E-05 0.4967854E-04
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4 0.47370 0.3696244E-05 0.4746992E-04
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4 0.73680 0.3187343E-05 0.4567686E-04
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4 1.00000 0.2776539E-05 0.4419665E-04
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5 -4.00000 0.1484896E-04 0.8043205E-04 1.0252
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5 -3.73680 0.1793696E-04 0.9535468E-04
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5 -3.47370 0.2403943E-04 0.1178584E-03
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5 -3.21050 0.3592285E-04 0.1548528E-03
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5 -2.94740 0.6257001E-04 0.2209219E-03
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|
5 -2.68420 0.1362300E-03 0.3442594E-03
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5 -2.42110 0.4716775E-03 0.5441910E-03
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5 -2.15790 0.2693852E-02 0.6684842E-03
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5 -1.89470 0.4716507E-03 0.5176416E-03
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5 -1.63160 0.1359024E-03 0.3242525E-03
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5 -1.36840 0.6210647E-04 0.2093897E-03
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5 -1.10530 0.3527616E-04 0.1477999E-03
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5 -0.84210 0.2267482E-04 0.1130586E-03
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5 -0.57890 0.1578437E-04 0.9190596E-04
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5 -0.31580 0.1161416E-04 0.7810486E-04
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5 -0.05260 0.8899806E-05 0.6859408E-04
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5 0.21050 0.7036911E-05 0.6176221E-04
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5 0.47370 0.5702227E-05 0.5669352E-04
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5 0.73680 0.4714050E-05 0.5282892E-04
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5 1.00000 0.3961623E-05 0.4980815E-04
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|
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6 -4.00000 0.3825722E-05 0.4866134E-04 1.0044
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6 -3.73680 0.3770014E-05 0.5140291E-04
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6 -3.47370 0.3984652E-05 0.5456576E-04
|
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6 -3.21050 0.4359613E-05 0.5839494E-04
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6 -2.94740 0.4999129E-05 0.6322063E-04
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6 -2.68420 0.6240379E-05 0.6953019E-04
|
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6 -2.42110 0.8079858E-05 0.7813257E-04
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|
6 -2.15790 0.1090310E-04 0.9046496E-04
|
|
6 -1.89470 0.1572637E-04 0.1092234E-03
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6 -1.63160 0.2442432E-04 0.1397729E-03
|
|
6 -1.36840 0.4323262E-04 0.1933165E-03
|
|
6 -1.10530 0.9592593E-04 0.2926672E-03
|
|
6 -0.84210 0.3552994E-03 0.4678372E-03
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6 -0.57890 0.3771256E-02 0.6492434E-03
|
|
6 -0.31580 0.3556512E-03 0.5818304E-03
|
|
6 -0.05260 0.9599783E-04 0.3778753E-03
|
|
6 0.21050 0.4321398E-04 0.2390786E-03
|
|
6 0.47370 0.2435163E-04 0.1636387E-03
|
|
6 0.73680 0.1561432E-04 0.1216980E-03
|
|
6 1.00000 0.1085317E-04 0.9667509E-04
|
|
|
|
7 -4.00000 0.3634566E-05 0.4861843E-04 1.0039
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|
7 -3.73680 0.3578783E-05 0.5134805E-04
|
|
7 -3.47370 0.3786755E-05 0.5450023E-04
|
|
7 -3.21050 0.4152806E-05 0.5832011E-04
|
|
7 -2.94740 0.4812893E-05 0.6313825E-04
|
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7 -2.68420 0.6159008E-05 0.6944297E-04
|
|
7 -2.42110 0.7943620E-05 0.7804509E-04
|
|
7 -2.15790 0.1062890E-04 0.9038492E-04
|
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7 -1.89470 0.1531214E-04 0.1091622E-03
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7 -1.63160 0.2380540E-04 0.1397441E-03
|
|
7 -1.36840 0.4215368E-04 0.1933289E-03
|
|
7 -1.10530 0.9360286E-04 0.2927099E-03
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7 -0.84210 0.3478719E-03 0.4678624E-03
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7 -0.57890 0.3865855E-02 0.6492077E-03
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7 -0.31580 0.3482181E-03 0.5818029E-03
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|
7 -0.05260 0.9367461E-04 0.3778909E-03
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7 0.21050 0.4213980E-04 0.2391011E-03
|
|
7 0.47370 0.2373852E-04 0.1636506E-03
|
|
7 0.73680 0.1521963E-04 0.1216999E-03
|
|
7 1.00000 0.1057827E-04 0.9667168E-04
|
|
|
|
8 -4.00000 0.8187523E-05 0.6277183E-04 1.0073
|
|
8 -3.73680 0.9036959E-05 0.7010063E-04
|
|
8 -3.47370 0.1088654E-04 0.7985642E-04
|
|
8 -3.21050 0.1400313E-04 0.9373864E-04
|
|
8 -2.94740 0.1951013E-04 0.1149226E-03
|
|
8 -2.68420 0.3010579E-04 0.1498275E-03
|
|
8 -2.42110 0.5299360E-04 0.2120300E-03
|
|
8 -2.15790 0.1165568E-03 0.3281770E-03
|
|
8 -1.89470 0.4186256E-03 0.5210230E-03
|
|
8 -1.63160 0.3067601E-02 0.6599997E-03
|
|
8 -1.36840 0.4183829E-03 0.5271646E-03
|
|
8 -1.10530 0.1165810E-03 0.3322027E-03
|
|
8 -0.84210 0.5302340E-04 0.2134177E-03
|
|
8 -0.57890 0.2998885E-04 0.1495563E-03
|
|
8 -0.31580 0.1925508E-04 0.1136391E-03
|
|
8 -0.05260 0.1339504E-04 0.9187650E-04
|
|
8 0.21050 0.9852867E-05 0.7776308E-04
|
|
8 0.47370 0.7548708E-05 0.6809726E-04
|
|
8 0.73680 0.5967682E-05 0.6118418E-04
|
|
8 1.00000 0.4835042E-05 0.5605834E-04
|
|
|
|
9 -4.00000 0.2769522E-04 0.1189815E-03 1.0438
|
|
9 -3.73680 0.4058188E-04 0.1574302E-03
|
|
9 -3.47370 0.7028934E-04 0.2256194E-03
|
|
9 -3.21050 0.1519452E-03 0.3525107E-03
|
|
9 -2.94740 0.5111051E-03 0.5566387E-03
|
|
9 -2.68420 0.2482185E-02 0.6781479E-03
|
|
9 -2.42110 0.5114343E-03 0.5207243E-03
|
|
9 -2.15790 0.1518877E-03 0.3254175E-03
|
|
9 -1.89470 0.7005416E-04 0.2103300E-03
|
|
9 -1.63160 0.3971804E-04 0.1487888E-03
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|
9 -1.36840 0.2553087E-04 0.1140986E-03
|
|
9 -1.10530 0.1777857E-04 0.9296265E-04
|
|
9 -0.84210 0.1308061E-04 0.7915007E-04
|
|
9 -0.57890 0.1002159E-04 0.6960572E-04
|
|
9 -0.31580 0.7920132E-05 0.6272435E-04
|
|
9 -0.05260 0.6417951E-05 0.5760171E-04
|
|
9 0.21050 0.5306261E-05 0.5369303E-04
|
|
9 0.47370 0.4459649E-05 0.5064842E-04
|
|
9 0.73680 0.3800261E-05 0.4823037E-04
|
|
9 1.00000 0.3276731E-05 0.4627256E-04
|
|
|
|
10 -4.00000 0.2522112E-02 0.5831493E-03 0.8944
|
|
10 -3.73680 0.4013963E-03 0.4322893E-03
|
|
10 -3.47370 0.1237954E-03 0.2693287E-03
|
|
10 -3.21050 0.5936529E-04 0.1755638E-03
|
|
10 -2.94740 0.3060337E-04 0.1254505E-03
|
|
10 -2.68420 0.1922893E-04 0.9709597E-04
|
|
10 -2.42110 0.1328417E-04 0.7972007E-04
|
|
10 -2.15790 0.9735230E-05 0.6827813E-04
|
|
10 -1.89470 0.7444826E-05 0.6030885E-04
|
|
10 -1.63160 0.5877529E-05 0.5452215E-04
|
|
10 -1.36840 0.4756314E-05 0.5018661E-04
|
|
10 -1.10530 0.3926838E-05 0.4685676E-04
|
|
10 -0.84210 0.3295494E-05 0.4424570E-04
|
|
10 -0.57890 0.2804163E-05 0.4216196E-04
|
|
10 -0.31580 0.2414784E-05 0.4047511E-04
|
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10 -0.05260 0.2101329E-05 0.3909411E-04
|
|
10 0.21050 0.1846117E-05 0.3795253E-04
|
|
10 0.47370 0.1634404E-05 0.3699943E-04
|
|
10 0.73680 0.1457253E-05 0.3619419E-04
|
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10 1.00000 0.1304500E-05 0.3550524E-04
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213 -4.00000 0.2483497E-02 0.5824301E-03 0.8937
|
|
213 -3.73680 0.4050864E-03 0.4314362E-03
|
|
213 -3.47370 0.1252620E-03 0.2687574E-03
|
|
213 -3.21050 0.6011217E-04 0.1752166E-03
|
|
213 -2.94740 0.3104691E-04 0.1252338E-03
|
|
213 -2.68420 0.1950575E-04 0.9695387E-04
|
|
213 -2.42110 0.1347499E-04 0.7962142E-04
|
|
213 -2.15790 0.9874931E-05 0.6820531E-04
|
|
213 -1.89470 0.7551595E-05 0.6025161E-04
|
|
213 -1.63160 0.5961780E-05 0.5447449E-04
|
|
213 -1.36840 0.4824453E-05 0.5014495E-04
|
|
213 -1.10530 0.3983051E-05 0.4681892E-04
|
|
213 -0.84210 0.3342624E-05 0.4421022E-04
|
|
213 -0.57890 0.2844224E-05 0.4212781E-04
|
|
213 -0.31580 0.2449246E-05 0.4044160E-04
|
|
213 -0.05260 0.2131293E-05 0.3906078E-04
|
|
213 0.21050 0.1872433E-05 0.3791914E-04
|
|
213 0.47370 0.1657694E-05 0.3696582E-04
|
|
213 0.73680 0.1478018E-05 0.3616025E-04
|
|
213 1.00000 0.1323030E-05 0.3547087E-04
|
|
|
|
214 -4.00000 0.2609977E-04 0.1254129E-03 1.0414
|
|
214 -3.73680 0.3827230E-04 0.1687010E-03
|
|
214 -3.47370 0.6641050E-04 0.2466349E-03
|
|
214 -3.21050 0.1441098E-03 0.3906926E-03
|
|
214 -2.94740 0.4924860E-03 0.6008369E-03
|
|
214 -2.68420 0.2622373E-02 0.6632784E-03
|
|
214 -2.42110 0.4928166E-03 0.4728034E-03
|
|
214 -2.15790 0.1440609E-03 0.2940951E-03
|
|
214 -1.89470 0.6620069E-04 0.1936340E-03
|
|
214 -1.63160 0.3747373E-04 0.1395795E-03
|
|
214 -1.36840 0.2407492E-04 0.1085969E-03
|
|
214 -1.10530 0.1675957E-04 0.8941692E-04
|
|
214 -0.84210 0.1232868E-04 0.7672297E-04
|
|
214 -0.57890 0.9444537E-05 0.6786711E-04
|
|
214 -0.31580 0.7463687E-05 0.6143527E-04
|
|
214 -0.05260 0.6047738E-05 0.5661970E-04
|
|
214 0.21050 0.4999958E-05 0.5292811E-04
|
|
214 0.47370 0.4202091E-05 0.5004131E-04
|
|
214 0.73680 0.3580727E-05 0.4774091E-04
|
|
214 1.00000 0.3087403E-05 0.4587312E-04
|
|
|
|
215 -4.00000 0.3768313E-05 0.5312015E-04 1.0046
|
|
215 -3.73680 0.3778637E-05 0.5713876E-04
|
|
215 -3.47370 0.4115881E-05 0.6204431E-04
|
|
215 -3.21050 0.4850647E-05 0.6834729E-04
|
|
215 -2.94740 0.6318485E-05 0.7684155E-04
|
|
215 -2.68420 0.8245682E-05 0.8887862E-04
|
|
215 -2.42110 0.1093675E-04 0.1069830E-03
|
|
215 -2.15790 0.1530193E-04 0.1361887E-03
|
|
215 -1.89470 0.2350465E-04 0.1870059E-03
|
|
215 -1.63160 0.4148907E-04 0.2810271E-03
|
|
215 -1.36840 0.9228382E-04 0.4492359E-03
|
|
215 -1.10530 0.3442181E-03 0.6395883E-03
|
|
215 -0.84210 0.3919118E-02 0.5969665E-03
|
|
215 -0.57890 0.3443257E-03 0.3928557E-03
|
|
215 -0.31580 0.9260592E-04 0.2473366E-03
|
|
215 -0.05260 0.4174312E-04 0.1680365E-03
|
|
215 0.21050 0.2345687E-04 0.1242680E-03
|
|
215 0.47370 0.1503266E-04 0.9837931E-04
|
|
215 0.73680 0.1044977E-04 0.8195490E-04
|
|
215 1.00000 0.7680859E-05 0.7089574E-04
|
|
|
|
216 -4.00000 0.3830820E-05 0.4866297E-04 1.0045
|
|
216 -3.73680 0.3775371E-05 0.5140479E-04
|
|
216 -3.47370 0.3990484E-05 0.5456787E-04
|
|
216 -3.21050 0.4366002E-05 0.5839730E-04
|
|
216 -2.94740 0.5005882E-05 0.6322325E-04
|
|
216 -2.68420 0.6242608E-05 0.6953308E-04
|
|
216 -2.42110 0.8083578E-05 0.7813572E-04
|
|
216 -2.15790 0.1091369E-04 0.9046839E-04
|
|
216 -1.89470 0.1574015E-04 0.1092272E-03
|
|
216 -1.63160 0.2444381E-04 0.1397773E-03
|
|
216 -1.36840 0.4326628E-04 0.1933223E-03
|
|
216 -1.10530 0.9599786E-04 0.2926768E-03
|
|
216 -0.84210 0.3555273E-03 0.4678537E-03
|
|
216 -0.57890 0.3768568E-02 0.6492603E-03
|
|
216 -0.31580 0.3558792E-03 0.5818343E-03
|
|
216 -0.05260 0.9606945E-04 0.3778744E-03
|
|
216 0.21050 0.4324727E-04 0.2390780E-03
|
|
216 0.47370 0.2437050E-04 0.1636390E-03
|
|
216 0.73680 0.1562645E-04 0.1216988E-03
|
|
216 1.00000 0.1086162E-04 0.9667607E-04
|
|
|
|
The file specfun_cum[BND].elself has been correctly written
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|
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Unfolding on the coarse grid
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INITIALIZATION:
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Electron-Phonon interpolation
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Total program execution
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EPW : 0.08s CPU 0.08s WALL
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Please consider citing:
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S. Ponce, E. R. Margine, C. Verdi and F. Giustino, Comput. Phys. Commun. 209, 116 (2016)
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|
|
In addition, if you used anisotropic Eliashberg superconductivity please cite:
|
|
E. R. Margine and F. Giustino, Phys. Rev. B 87, 024505 (2013)
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|
if you used transport properties (scattering rates, mobility) please cite:
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S. Ponce, E. R. Margine and F. Giustino, Phys. Rev. B 97, 121201 (2018)
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