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quantum-espresso/test-suite/cp_h2o_wf
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Hsin-Yu Ko 1450415300 revise test case 2021-06-29 15:01:23 -04:00
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README add test cases 2021-06-29 12:32:32 -04:00
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README 

Electron minimization of CP-WF is protocol-dependent. In this test, `nstep` is
intentionally chosen to be too small to reach full convergence to the ground state.
Doing so increases the sensitivity of the test on the protocol-dependence, which
could be useful in probing inconsistent changes in the MLWF routines.