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Update tolerance for the deterministic tests
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Hyeondeok-Shin committed Aug 9, 2022
1 parent 7a14b18 commit 4015669
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Showing 2 changed files with 4 additions and 4 deletions.
2 changes: 1 addition & 1 deletion tests/solids/diamondC_1x1x1_pp/CMakeLists.txt
Original file line number Diff line number Diff line change
Expand Up @@ -1157,7 +1157,7 @@ if(NOT QMC_CUDA)
list(APPEND DET_DIAMOND_EXCITED_SCALARS "eeenergy" "-3.54361899 0.00001190")
list(APPEND DET_DIAMOND_EXCITED_SCALARS "ionion" "-12.77567050 0.000001")
list(APPEND DET_DIAMOND_EXCITED_SCALARS "localecp" "-8.35089725 0.00001516")
list(APPEND DET_DIAMOND_EXCITED_SCALARS "nonlocalecp" "-0.14905431 0.00000595")
list(APPEND DET_DIAMOND_EXCITED_SCALARS "nonlocalecp" "-0.14905431 0.00002")
list(APPEND DET_DIAMOND_EXCITED_SCALARS "mpc" "-3.24606471 0.00001149")
list(APPEND DET_DIAMOND_EXCITED_SCALARS "samples" "9 0.0")
list(APPEND DET_DIAMOND_EXCITED_SCALARS "flux" "-3.81746292 0.00004665")
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6 changes: 3 additions & 3 deletions tests/solids/diamondC_2x1x1_pp/CMakeLists.txt
Original file line number Diff line number Diff line change
Expand Up @@ -1586,12 +1586,12 @@ else()
list(APPEND DET_DIAMOND2_EXCITED_SCALARS "totenergy" "-22.19196667 0.00002")
list(APPEND DET_DIAMOND2_EXCITED_SCALARS "kinetic" "18.95319569 0.00002")
list(APPEND DET_DIAMOND2_EXCITED_SCALARS "potential" "-41.14516236 0.00003")
list(APPEND DET_DIAMOND2_EXCITED_SCALARS "eeenergy" "-3.88188177 0.000001")
list(APPEND DET_DIAMOND2_EXCITED_SCALARS "eeenergy" "-3.88188177 0.000005")
list(APPEND DET_DIAMOND2_EXCITED_SCALARS "ionion" "-25.55132693 0.000001")
list(APPEND DET_DIAMOND2_EXCITED_SCALARS "localecp" "-11.23308424 0.00005")
list(APPEND DET_DIAMOND2_EXCITED_SCALARS "nonlocalecp" "-0.47886942 0.00001")
list(APPEND DET_DIAMOND2_EXCITED_SCALARS "samples" "9.00000000 0.0")
list(APPEND DET_DIAMOND2_EXCITED_SCALARS "flux" "126.46941612 0.00004")
list(APPEND DET_DIAMOND2_EXCITED_SCALARS "flux" "126.46941612 0.003")
else()
list(APPEND DET_DIAMOND2_EXCITED_SCALARS "totenergy" "-22.19531111 0.00001")
list(APPEND DET_DIAMOND2_EXCITED_SCALARS "kinetic" "18.94980840 0.00002")
Expand All @@ -1601,7 +1601,7 @@ else()
list(APPEND DET_DIAMOND2_EXCITED_SCALARS "localecp" "-11.23303633 0.00005")
list(APPEND DET_DIAMOND2_EXCITED_SCALARS "nonlocalecp" "-0.47885103 0.00001")
list(APPEND DET_DIAMOND2_EXCITED_SCALARS "samples" "9.00000000 0.0")
list(APPEND DET_DIAMOND2_EXCITED_SCALARS "flux" "126.44713222 0.00004")
list(APPEND DET_DIAMOND2_EXCITED_SCALARS "flux" "126.44713222 0.0001")
endif()
else()
if(QMC_COMPLEX)
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