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Resolver CI failure on 01_PW/211_PW_BPCG_KB_OCP_CHG
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Lines changed: 679 additions & 679 deletions

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tests/01_PW/211_PW_BPCG_KB_OCP_CHG/INPUT

Lines changed: 4 additions & 4 deletions
Original file line numberDiff line numberDiff line change
@@ -6,8 +6,8 @@ pseudo_dir ../../PP_ORB
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symmetry 0
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ecutwfc 10
9-
scf_thr 1e-8
10-
scf_nmax 50
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scf_thr 1e-10
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scf_nmax 100
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mixing_type broyden
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mixing_beta 0.4
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@@ -16,10 +16,10 @@ ks_solver bpcg
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kpar 2
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bndpar 2
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pw_seed 1
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pw_diag_thr 1e-8
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pw_diag_thr 1e-10
2020

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smearing_method fixed
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ocp 1
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ocp_set 4*0.5 3*0 3*0.5 0.4999 0.0001 2*0 3*0.5 0.4998 0.0002 2*0 3*0.5 0.4997 0.0003 2*0
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out_chg 1
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out_chg 1 10

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