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update CASES_CPU.txt, move 284 to 511
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7 files changed

+7
-13
lines changed

7 files changed

+7
-13
lines changed

tests/integrate/284_NO_KP_PBE0/result.ref

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tests/integrate/284_NO_KP_PBE0/INPUT renamed to tests/integrate/511_NO_KP_PBE0/INPUT

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@@ -7,8 +7,8 @@ gamma_only 0
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nspin 1
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#Parameters (2.Iteration)
10-
ecutwfc 20
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scf_thr 1E-5
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ecutwfc 10
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scf_thr 1E-7
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scf_nmax 100
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calculation scf
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tests/integrate/284_NO_KP_PBE0/STRU renamed to tests/integrate/511_NO_KP_PBE0/STRU

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@@ -2,7 +2,7 @@ ATOMIC_SPECIES
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Si 1.000 Si_dojo_nsoc.upf
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NUMERICAL_ORBITAL
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Si_dojo_6au.orb
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Si_dojo_6au_sz.orb
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LATTICE_CONSTANT
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1.889766
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@@ -0,0 +1,3 @@
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etotref -190.0780619156031
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etotperatomref -95.0390309578
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totaltimeref 2.80

tests/integrate/CASES_CPU.txt

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@@ -197,13 +197,6 @@
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260_NO_DJ_PK_PU_AFM_URAMPING
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270_NO_MD_1O
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270_NO_MD_2O
200-
281_NO_KP_HSE
201-
281_NO_KP_HSE_symmetry
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282_NO_KP_HSE_complex
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283_NO_KP_HF
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284_NO_KP_PBE0
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285_NO_KP_RE_HSE
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286_NO_KP_CR_HSE
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#282_NO_RPA
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283_NO_restart
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284_NO_KP_symmetry
@@ -248,6 +241,7 @@
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508_NO_KP_HSE_symm
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509_NO_KP_HSE_comp
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510_NO_KP_HF
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511_NO_KP_PBE0
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551_NO_GO_LR
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552_NO_GO_LR_PBE
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553_NO_GO_LR_HF

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