{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.036246 0.517989 0.7873767 ] [ 1.003677 0.2248323 2.613371 ] [ 0.7358478 1.683575 1.603856 ] [ 2.917767 0.7228741 0.0191295 ] [ 2.564023 2.34008 0.1827334 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.036246e-10 5.17989e-11 7.873767e-11 ] [ 1.003677e-10 2.248323e-11 2.613371e-10 ] [ 7.358478000000001e-11 1.683575e-10 1.603856e-10 ] [ 2.917767e-10 7.228741e-11 1.91295e-12 ] [ 2.564023e-10 2.34008e-10 1.827334e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.8385985 -20.4407962 -25.7348418 ] [ 2.835529 -14.5226869 21.6402402 ] [ -8.2413741 33.7014984 6.0590112 ] [ 8.6266744 -14.9475332 -3.4266953 ] [ -2.3822309 16.2095179 1.4622857 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.343582910937949e-09 -3.274976578217748e-08 -4.12317618719466e-08 ] [ 4.543018271400404e-09 -2.326790942237843e-08 3.467148691693632e-08 ] [ -1.320413690628664e-08 5.399575282240861e-08 9.707606089805353e-09 ] [ 1.382145603893387e-08 -2.394858823167181e-08 -5.490171096265242e-09 ] [ -3.816754653327343e-09 2.597051061381912e-08 2.342839961470163e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 14.8694943645911 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.382355623406521e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.7278236 0.42051 0.1471744 ] [ 1.8812779 0.5779145 2.3785688 ] [ 0.2783698 2.129478 1.6783213 ] [ 3.0246512 0.0662657 0.4042516 ] [ 2.3454383 2.2951821 0.5981504 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.278236e-11 4.2051e-11 1.471744e-11 ] [ 1.8812779e-10 5.779145e-11 2.3785688e-10 ] [ 2.783698e-11 2.129478e-10 1.6783213e-10 ] [ 3.0246512e-10 6.62657e-12 4.042516e-11 ] [ 2.3454383e-10 2.2951821e-10 5.981504e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.2e-06 7.6e-06 -1.36e-05 ] [ 6.4e-06 -9.8e-06 1.02e-05 ] [ 8.9e-06 -2e-07 2.9e-06 ] [ -7.6e-06 2.8e-06 1.31e-05 ] [ -1.29e-05 -2e-07 -1.26e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.33131842816e-15 1.217654231808e-14 -2.178960204288e-14 ] [ 1.025393037312e-14 -1.570133088384e-14 1.634220153216e-14 ] [ 1.425937192512e-14 -3.2043532416e-16 4.646312200320001e-15 ] [ -1.217654231808e-14 4.48609453824e-15 2.098851373248e-14 ] [ -2.066807840832e-14 -3.2043532416e-16 -2.018742542208e-14 ] ] } "relaxed-potential-energy" { "source-value" -5.7659997754089005 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.238150035698192e-19 } }