{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.4009464 1.193297 0.9558509 ] [ 0.2244953 2.906435 0.4394059 ] [ 0.3187826 2.815079 2.795658 ] [ 1.502588 0.0124763 2.860219 ] [ 2.103704 2.743898 0.1444875 ] [ 2.704733 1.991532 2.940817 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.009464e-11 1.193297e-10 9.558509e-11 ] [ 2.244953e-11 2.906435e-10 4.394059e-11 ] [ 3.187826e-11 2.815079e-10 2.795658e-10 ] [ 1.502588e-10 1.24763e-12 2.860219e-10 ] [ 2.103704e-10 2.743898e-10 1.444875e-11 ] [ 2.704733e-10 1.991532e-10 2.940817e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.5085772 -8.0533784 2.4031053 ] [ -6.6234692 7.7283154 -1.5601513 ] [ 0.8774928 -0.289119 0.8315102 ] [ -0.4182729 0.3188903 -0.5239131 ] [ 6.5214384 -0.4982743 -0.4152455 ] [ -0.8657663 0.793566 -0.7353056 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.148304997119257e-10 -1.290293459093571e-08 3.85019912898057e-09 ] [ -1.061196750082888e-08 1.23821262520486e-08 -2.499637937770727e-09 ] [ 1.40589844908033e-09 -4.632197024290752e-10 1.332226202396732e-09 ] [ -6.701470614942163e-10 5.109185832598982e-10 -8.394013201508525e-10 ] [ 1.044849613846736e-08 -7.983234342054855e-10 -6.652966319924064e-10 ] [ -1.387110524936519e-09 1.271432892261773e-09 -1.178089441463317e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.862866 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.541511304408322e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.6596612 0.7079171 0.475938 ] [ 0.0174419 2.9991047 0.8131086 ] [ 0.4458786 2.7811522 3.1099747 ] [ 1.0881784 0.4899923 2.7727912 ] [ 2.3078146 2.4512098 0.3338774 ] [ 2.7362746 2.2333413 2.6307484 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.596612e-11 7.079171e-11 4.75938e-11 ] [ 1.74419e-12 2.9991047e-10 8.131086e-11 ] [ 4.458786e-11 2.7811522e-10 3.1099747e-10 ] [ 1.0881784e-10 4.899923e-11 2.7727912e-10 ] [ 2.3078146e-10 2.4512098e-10 3.338774e-11 ] [ 2.7362746e-10 2.2333413e-10 2.6307484e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6e-06 1.34e-05 -3.3e-06 ] [ 6.1e-06 -2.57e-05 5.1e-06 ] [ 1.36e-05 8.8e-06 1.7e-06 ] [ -3.1e-06 6.7e-06 1.6e-06 ] [ -4e-07 6e-06 8.8e-06 ] [ -2.23e-05 -9.2e-06 -1.38e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.6130597248e-15 2.146916671872e-14 -5.28718284864e-15 ] [ 9.77327738688e-15 -4.117593915456e-14 8.17110076608e-15 ] [ 2.178960204288e-14 1.409915426304e-14 2.72370025536e-15 ] [ -4.96674752448e-15 1.073458335936e-14 2.56348259328e-15 ] [ -6.408706483200001e-16 9.6130597248e-15 1.409915426304e-14 ] [ -3.572853864384e-14 -1.474002491136e-14 -2.211003736704e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.411418 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.27026967169763e-18 } }