{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.528767 2.719521 3.332257 ] [ 2.679869 4.813542 3.129006 ] [ 6.091314 2.864553 1.221181 ] [ 3.782186 2.699172 1.048642 ] [ 4.900359 1.620716 3.350029 ] [ 4.704911 4.540373 1.710823 ] [ 4.562967 3.751533 4.052534 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.528767e-10 2.719521e-10 3.332257e-10 ] [ 2.679869e-10 4.813542e-10 3.129006e-10 ] [ 6.091314e-10 2.864553e-10 1.221181e-10 ] [ 3.782186e-10 2.699172e-10 1.048642e-10 ] [ 4.900359e-10 1.620716e-10 3.350029e-10 ] [ 4.704911e-10 4.540373e-10 1.710823e-10 ] [ 4.562967000000001e-10 3.751533e-10 4.052534e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.1688646 -3.0895155 -0.2448398 ] [ 0.4896582 2.2779739 -0.5546358 ] [ 0.3934019 -1.4300774 0.7040585 ] [ -1.55228 -1.9492955 -0.2917525 ] [ -0.0056299 -0.0782645 -1.1059836 ] [ 0.1711007 3.327938 0.7417628 ] [ 0.3348845 0.9412409 0.7513903 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.705509164297564e-10 -4.949949544480827e-09 -3.922766066332331e-10 ] [ 7.845189266864987e-10 3.649716555441852e-09 -8.886245191398971e-10 ] [ 6.302993319512045e-10 -2.291236595091472e-09 1.128026077669089e-09 ] [ -2.48702674542552e-09 -3.123115702861347e-09 -4.674390384110849e-10 ] [ -9.020094231756599e-12 -1.25393553171693e-10 -1.771981081507202e-09 ] [ 2.741335436010438e-10 5.331944503000692e-09 1.188435026130415e-09 ] [ 5.36544120988773e-10 1.508034176945131e-09 1.20385998167425e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -19.646374 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.147696136562511e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6817463 2.0472078 2.9166596 ] [ 2.8185895 4.4360573 2.9503038 ] [ 5.5991272 2.4992387 1.4203121 ] [ 3.3601751 3.1809092 0.9214334 ] [ 4.9493282 1.8785147 3.6263196 ] [ 4.9749947 4.7701801 1.8442802 ] [ 4.866412 4.1973023 4.1651634 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6817463e-10 2.0472078e-10 2.9166596e-10 ] [ 2.8185895e-10 4.4360573e-10 2.9503038e-10 ] [ 5.5991272e-10 2.4992387e-10 1.4203121e-10 ] [ 3.3601751e-10 3.1809092e-10 9.214334e-11 ] [ 4.9493282e-10 1.8785147e-10 3.6263196e-10 ] [ 4.9749947e-10 4.7701801e-10 1.8442802e-10 ] [ 4.866412000000001e-10 4.1973023e-10 4.1651634e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.67e-05 -2.03e-05 -1.07e-05 ] [ -1.62e-05 9.7e-06 8.3e-06 ] [ 7.4e-06 -3.6e-06 -3.5e-06 ] [ 3.3e-06 1e-05 -1.9e-06 ] [ 4.5e-06 -7e-06 1.08e-05 ] [ 1e-07 -3.7e-06 -7.9e-06 ] [ 1.76e-05 1.48e-05 4.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.67563497878e-14 -3.252418567019999e-14 -1.71432899838e-14 ] [ -2.59552614708e-14 1.55411133498e-14 1.32980660622e-14 ] [ 1.18561070916e-14 -5.767835882399999e-15 -5.607618218999999e-15 ] [ 5.2871828922e-15 1.602176634e-14 -3.0441356046e-15 ] [ 7.209794853e-15 -1.1215236438e-14 1.73035076472e-14 ] [ 1.602176634e-16 -5.9280535458e-15 -1.26571954086e-14 ] [ 2.81983087584e-14 2.37122141832e-14 7.850665506599998e-15 ] ] } "relaxed-potential-energy" { "source-value" -21.541441 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.451319343288959e-18 } }