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INIWAV = 1

ISYM = 0

ENCUT = 800
ENAUG = 2400
PREC = high
MAXMIX = 40
EDIFF = 0.001
NELMIN = 4

ISMEAR = -1
SIGMA = 0.172

IBRION = 0
LREAL = .FALSE.

ALGO = Very Fast

NSW = 1000

LCHARG = .FALSE.
LWAVE = .TURE.
TEBEG = 2000.0
TEEND = 2000.0

SMASS = 0
NBLOCK = 50
POTIM = 1.0

PSTRESS = 1500
ISIF = 3

PMASS = 20

DMALGO = 3
LANGEVIN_GAMMA = 50,50,50
LANGEVIN_GAMMA_L = 50

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in kB 4173.13620 3884.51263 4207.21849 10.00879 29.47044 -5.27320


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in kB 1500.29745 1500.58586 1500.17384 -0.00009 0.00002 0.00000
in kB 1500.10129 1500.25323 1499.81734 0.00016 0.00004 0.00002
in kB 1500.08360 1500.17931 1499.73520 0.00020 0.00001 0.00001
in kB 1500.07581 1500.15166 1499.90178 0.00048 0.00001 -0.00001
in kB 1500.07394 1500.13570 1500.00074 0.00028 0.00001 0.00000

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