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qmcpack/tests/molecules/C2_pp/QuantumPackage
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anbenali 21bc31995d Fixing tests for HDF5, molecular tests and convert4qmc for UHF/UKS 2020-08-26 17:12:41 -05:00
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C2-Dump-1e-3.out Fixing tests for HDF5, molecular tests and convert4qmc for UHF/UKS 2020-08-26 17:12:41 -05:00
C2.xyz Add script and output of QuantumPackage for C2. 2017-10-21 16:11:55 -05:00
script.sh Fixing tests for HDF5, molecular tests and convert4qmc for UHF/UKS 2020-08-26 17:12:41 -05:00