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add to-be-admin-updated UnitConversion to test
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‎test/test_scripts_and_data/custom_kimitems/verification-checks/UnitConversion__VC_128739598203_001/LICENSE.CDDL‎

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‎test/test_scripts_and_data/custom_kimitems/verification-checks/UnitConversion__VC_128739598203_001/Makefile‎

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all:
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@echo "Nothing to make"
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clean:
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@echo "Nothing to clean"

‎test/test_scripts_and_data/custom_kimitems/verification-checks/UnitConversion__VC_128739598203_001/kimprovenance.edn‎

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[{"checksums" {"LICENSE.CDDL" "28c444cd138cbc7e8d6cb9bbe761a545bdec0e93"
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"Makefile" "611f4409c90c9e358f9cc126c6e5469e50739f7b"
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"kimspec.edn" "81a74fe2279d4f999500da78240b183323422602"
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"pipeline.stdin.tpl" "dcea8adbb6d337d26b3868e21fb09170e1564475"
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"requirements.txt" "f21830d28557d3398425827a5b2fb651b5a79f7a"
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"results.edn.tpl" "31f0bbc6e4908c56ca5c1414de7a71054e5d9dec"
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"runner" "902d8eb599a514ee0c72d603f571a776bc011678"}
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"comments" "add 'matching-models' field to runners and 'run-compatibility' to SMs kimspec.edn"
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"event-type" "admin-update"
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"extended-id" "UnitConversion__VC_128739598203_001"
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"timestamp" "2023-11-28 11:05:47"
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"user-id" "66443d60-a76c-472c-987e-dd80fde07aae"}
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{"checksums" {"LICENSE.CDDL" "28c444cd138cbc7e8d6cb9bbe761a545bdec0e93"
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"Makefile" "611f4409c90c9e358f9cc126c6e5469e50739f7b"
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"kimspec.edn" "893f5bd6053b2298eb003f2f1d613036938672fc"
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"pipeline.stdin.tpl" "dcea8adbb6d337d26b3868e21fb09170e1564475"
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"requirements.txt" "f21830d28557d3398425827a5b2fb651b5a79f7a"
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"results.edn.tpl" "31f0bbc6e4908c56ca5c1414de7a71054e5d9dec"
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"runner" "902d8eb599a514ee0c72d603f571a776bc011678"}
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"comments" ""
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"event-type" "revised-version-creation"
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"extended-id" "UnitConversion__VC_128739598203_001"
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"timestamp" "2021-06-30 02:51:19"
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"user-id" "4d62befd-21c4-42b8-a472-86132e6591f3"}
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{"checksums" {"LICENSE.CDDL" "28c444cd138cbc7e8d6cb9bbe761a545bdec0e93"
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"Makefile" "611f4409c90c9e358f9cc126c6e5469e50739f7b"
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"kimspec.edn" "6e55e746f7e3c7fa93b6ac0a61f20cb454e164d4"
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"pipeline.stdin.tpl" "dcea8adbb6d337d26b3868e21fb09170e1564475"
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"requirements.txt" "0a4641e555334f413e68166e075d87771da6591a"
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"results.edn.tpl" "31f0bbc6e4908c56ca5c1414de7a71054e5d9dec"
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"runner" "102d33700a432a0acd6f58d9014a1c6172032ba8"}
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"comments" "Change top-level 'author' key to 'creator'"
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"event-type" "metadata-update"
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"extended-id" "UnitConversion__VC_128739598203_000"
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"timestamp" "2020-09-26 16:52:03"
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"user-id" "4d62befd-21c4-42b8-a472-86132e6591f3"}
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{"checksums" {"LICENSE.CDDL" "28c444cd138cbc7e8d6cb9bbe761a545bdec0e93"
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"Makefile" "611f4409c90c9e358f9cc126c6e5469e50739f7b"
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"kimspec.edn" "bef8deb79d33584c911ac8a29e692cac8b16821b"
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"pipeline.stdin.tpl" "dcea8adbb6d337d26b3868e21fb09170e1564475"
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"requirements.txt" "0a4641e555334f413e68166e075d87771da6591a"
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"results.edn.tpl" "31f0bbc6e4908c56ca5c1414de7a71054e5d9dec"
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"runner" "102d33700a432a0acd6f58d9014a1c6172032ba8"}
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"comments" "Fix bug for selecting diameter for cluster generation"
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"event-type" "admin-update"
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"extended-id" "UnitConversion__VC_128739598203_000"
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"timestamp" "2019-09-09 15:59:17"
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"user-id" "4d62befd-21c4-42b8-a472-86132e6591f3"}
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{"checksums" {"LICENSE.CDDL" "28c444cd138cbc7e8d6cb9bbe761a545bdec0e93"
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"Makefile" "611f4409c90c9e358f9cc126c6e5469e50739f7b"
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"kimspec.edn" "bef8deb79d33584c911ac8a29e692cac8b16821b"
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"pipeline.stdin.tpl" "dcea8adbb6d337d26b3868e21fb09170e1564475"
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"requirements.txt" "0a4641e555334f413e68166e075d87771da6591a"
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"results.edn.tpl" "31f0bbc6e4908c56ca5c1414de7a71054e5d9dec"
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"runner" "a1a2066d4284951752524d75d3684fb24bf229a1"}
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"comments" ""
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"event-type" "initial-creation"
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"extended-id" "UnitConversion__VC_128739598203_000"
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"timestamp" "2019-09-05 06:07:55"
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"user-id" "4d62befd-21c4-42b8-a472-86132e6591f3"}]

‎test/test_scripts_and_data/custom_kimitems/verification-checks/UnitConversion__VC_128739598203_001/kimspec.edn‎

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{
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"contributor-id" "4d62befd-21c4-42b8-a472-86132e6591f3"
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"description" "This verification check ensures that a model can properly convert units of length and energy. Working in one unit system, a random cluster of atoms is generated based on the smallest cutoff of the model such that the energy and/or forces (depending on what the model actually reports) are sizeable. Next, the model is reinitialized with a different set of registered units. The coordinates of the atoms in the cluster are rescaled to correspond to the new length units and the energy and/or forces are requested from the model once again. The energy and/or force returned by the model are then compared to a manual conversion of those originally returned (in the first set of units).\n\n\nHISTORY:\n\nChanges in version 001:\n* Update for compatibility with kimpy 2.0.0"
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"developer" [
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"4d62befd-21c4-42b8-a472-86132e6591f3"
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]
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"doi" "10.25950/3efea563"
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"domain" "openkim.org"
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"executables" [
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"runner"
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]
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"extended-id" "UnitConversion__VC_128739598203_001"
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"kim-api-version" "2.0"
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"maintainer-id" "4d62befd-21c4-42b8-a472-86132e6591f3"
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"matching-models" [
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"standard-models"
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]
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"properties" [
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"tag:tadmor@noreply.openkim.org,2017-02-01:property/verification-check"
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]
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"publication-year" "2021"
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"simulator-name" "none"
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"title" "Verification check of unit conversion v001"
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}

‎test/test_scripts_and_data/custom_kimitems/verification-checks/UnitConversion__VC_128739598203_001/pipeline.stdin.tpl‎

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@< MODELNAME >@

‎test/test_scripts_and_data/custom_kimitems/verification-checks/UnitConversion__VC_128739598203_001/requirements.txt‎

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numpy >= 1.13.1
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kimpy >= 2.0.0
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kim_python_utils >= 0.0.0

‎test/test_scripts_and_data/custom_kimitems/verification-checks/UnitConversion__VC_128739598203_001/results.edn.tpl‎

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{
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"property-id" "tag:tadmor@noreply.openkim.org,2017-02-01:property/verification-check"
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"instance-id" 1
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"vc-name" {
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"source-value" "@<vc_name>@"
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}
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"vc-description" {
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"source-value" "@<vc_description>@"
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}
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"vc-category" {
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"source-value" "@<vc_category>@"
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}
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"vc-grade-basis" {
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"source-value" "@<vc_grade_basis>@"
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}
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"vc-grade" {
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"source-value" "@<vc_grade>@"
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}
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"vc-comment" {
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"source-value" "@<vc_comment>@"
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}
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"vc-files" {
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"source-value" @<vc_files>@
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}
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}

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