예제 #1
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def test_h3_os_pbe():
    check_h3_os_pbe(ODASCFSolver(threshold=1e-6))
예제 #2
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def test_h3_os_pbe():
    check_h3_os_pbe(EDIIS2SCFSolver(threshold=1e-6))
예제 #3
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def test_h3_os_pbe():
    check_h3_os_pbe(ODASCFSolver(threshold=1e-6))
예제 #4
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def test_h3_os_pbe():
    check_h3_os_pbe(EDIIS2SCFSolver(threshold=1e-6))