cpmd: add expected smoke test check output (#21668)
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@ -98,4 +98,8 @@ def test(self):
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exe_name = 'cpmd.x'
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exe_name = 'cpmd.x'
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opts.append(test_file)
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opts.append(test_file)
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opts.append(test_dir)
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opts.append(test_dir)
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self.run_test(exe_name, options=opts)
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expected = ['2 1 H O 1.84444 0.97604',
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'3 1 H O 1.84444 0.97604',
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'2 1 3 H O H 103.8663'
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]
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self.run_test(exe_name, options=opts, expected=expected)
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