mirror of https://gitlab.com/QEF/q-e.git
50 lines
1.7 KiB
Plaintext
50 lines
1.7 KiB
Plaintext
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Program PROJWFC v.6.1 (svn rev. 13369) starts on 24May2017 at 12:14:49
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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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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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Reading data from directory:
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/home/asmoguno/ESPRESSOs/qe-6.1/tempdir/par.save
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Info: using nr1, nr2, nr3 values from input
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Info: using nr1, nr2, nr3 values from input
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IMPORTANT: XC functional enforced from input :
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Exchange-correlation = SLA PW PBX PBC ( 1 4 3 4 0 0)
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Any further DFT definition will be discarded
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Please, verify this is what you really want
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file CorelUSPBE.RRKJ3.UPF: wavefunction(s) 4P 4P 3D renormalized
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G-vector sticks info
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--------------------
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sticks: dense smooth PW G-vecs: dense smooth PW
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Sum 313 151 55 43773 15409 3373
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Check: negative/imaginary core charge= -0.000023 0.000000
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negative rho (up, down): 1.071E-02 4.332E-01
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Gaussian broadening (read from input): ngauss,degauss= -1 0.005000
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Calling projwave_nc ....
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PROJWFC : 6.27s CPU 7.96s WALL
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This run was terminated on: 12:14:57 24May2017
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=------------------------------------------------------------------------------=
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JOB DONE.
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=------------------------------------------------------------------------------=
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