mirror of https://gitlab.com/QEF/q-e.git
8 lines
334 B
Plaintext
8 lines
334 B
Plaintext
This example shows how to use cp.x together with pw.x
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to perform an electronic minimization at Gamma for SiO2.
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Note that
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- it works only for Gamma point, of course
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- it is no longer needed to set "wf_collect" to .t.
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- the number of bands should be the same for CP and PW
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- "prefix" for pw.x = "prefix"_"ndr" or "prefix_ndw" for cp.x
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