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Update tests for coming merge.
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elbriggs committed Mar 29, 2023
1 parent a9bc109 commit 80fe7b1
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Showing 29 changed files with 16,381 additions and 16,001 deletions.
2 changes: 1 addition & 1 deletion tests/RMG/AlN32/input
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@@ -1,6 +1,6 @@
# Description of run.
# Energy test
test_energy="-215.98548688"
test_energy="-215.98792090"
test_steps = "14"
test_steps_tolerance = "1"

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757 changes: 385 additions & 372 deletions tests/RMG/AlN32/input.ref.log

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829 changes: 421 additions & 408 deletions tests/RMG/C60/input.ref.log

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1,228 changes: 697 additions & 531 deletions tests/RMG/CO/input.00.log

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2 changes: 1 addition & 1 deletion tests/RMG/CO_ccECP/input
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Expand Up @@ -12,7 +12,7 @@ occupations_type = "Fixed"
renormalize_forces = "false"

#write_pseudopotential_plots = "true"
test_energy="-21.70720517"
test_energy="-21.70720724"

#verbose="true"

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710 changes: 358 additions & 352 deletions tests/RMG/CO_ccECP/input.00.log

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2 changes: 1 addition & 1 deletion tests/RMG/Diamond16/input
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Expand Up @@ -9,7 +9,7 @@

# Description of run. Default: "QMD run"
description="Diamond 16 atom test cell"
test_energy = "-91.81035226"
test_energy = "-91.81044667"
test_steps = "9"
test_steps_tolerance = "2"

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723 changes: 379 additions & 344 deletions tests/RMG/Diamond16/input.ref.log

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2 changes: 1 addition & 1 deletion tests/RMG/Diamond2/input
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Expand Up @@ -9,7 +9,7 @@ localize_projectors = "false"
compressed_infile = "false"
compressed_outfile = "false"

test_energy = "-11.38920211"
test_energy = "-11.38921213"
test_steps = "9"
test_steps_tolerance = "2"

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