atomate.tools.tests package¶
Submodules¶
atomate.tools.tests.test_quasiharmonic_debye_approx module¶
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class
atomate.tools.tests.test_quasiharmonic_debye_approx.TestQuasiharmociDebyeApprox(methodName='runTest')¶ Bases:
unittest.case.TestCase-
setUp()¶
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test_bulk_modulus()¶
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test_debye_temperature()¶
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test_gruneisen_paramter()¶
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test_optimum_volume()¶
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test_thermal_conductivity()¶
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test_vibrational_free_energy()¶
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test_vibrational_internal_energy()¶
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