mirror of https://gitlab.com/QEF/q-e.git
21 lines
1.1 KiB
Plaintext
21 lines
1.1 KiB
Plaintext
10 0.12 1 ! emax (something more than highest phonon mode in THz), degauss, smearing method
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8 ! Number of q-points for which EPC is calculated,
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0.0000000 0.0000000 0.0000000 1.00 ! the first q-point, use kpoints.x program to calculate
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-0.2500000 -0.2500000 0.2500000 8.00 ! q-points and their weight
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-0.5000000 -0.5000000 0.5000000 4.00 !
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0.0000000 0.0000000 0.5000000 6.00 ! 4th q-point, qx,qy,qz
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-0.2500000 -0.2500000 0.7500000 24.00 !
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-0.5000000 -0.5000000 1.0000000 12.00 !
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0.0000000 0.0000000 1.0000000 3.00 !
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-0.5000000 0.0000000 1.0000000 6.00 ! the last q-point
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elph_dir/elph.inp_lambda.1 ! elph output file names,
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elph_dir/elph.inp_lambda.2 ! in the same order as the q-points before
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elph_dir/elph.inp_lambda.3
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elph_dir/elph.inp_lambda.4
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elph_dir/elph.inp_lambda.5
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elph_dir/elph.inp_lambda.6
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elph_dir/elph.inp_lambda.7
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elph_dir/elph.inp_lambda.8
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0.10 ! \mu the Coloumb coefficient in the modified
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! Allen-Dynes formula for T_c (via \omega_log)
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