{ "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" [ [ 0.3527209 0.4565602 1.167471 ] [ 0.6414148 2.926013 0.4472085 ] [ 0.2560781 2.125953 2.651252 ] [ 2.793307 0.1807352 2.367537 ] [ 2.546309 2.149048 0.8335699 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.527209e-11 4.565602e-11 1.167471e-10 ] [ 6.414148e-11 2.926013000000001e-10 4.472085e-11 ] [ 2.560781e-11 2.125953e-10 2.651252e-10 ] [ 2.793307e-10 1.807352e-11 2.367537e-10 ] [ 2.546309e-10 2.149048e-10 8.335699e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.2231391 3.2885066 3.1441448 ] [ -2.0318947 0.3427306 1.1557559 ] [ 0.2393071 -2.9079674 -4.4729442 ] [ 0.0 0.0 0.0 ] [ 2.0157267 -0.7232698 0.1730434 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.575082492063533e-10 5.268768391866497e-09 5.037475290969892e-09 ] [ -3.25545418426743e-09 5.491149545527565e-10 1.851725082331663e-09 ] [ 3.834122408114477e-10 -4.659077382328562e-09 -7.166446623382959e-09 ] [ 0.0 0.0 0.0 ] [ 3.229550192662335e-09 -1.158805964090692e-09 2.772460898637427e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -5.664142 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.074955889291354e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.2452166 0.11707 1.5091495 ] [ 0.8410246 3.3396473 0.6731156 ] [ -0.1005892 2.1458299 2.2850381 ] [ 3.0421728 0.2937771 2.1936874 ] [ 2.5620049 1.9419852 0.8060477 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.452166e-11 1.1707e-11 1.5091495e-10 ] [ 8.410246000000001e-11 3.3396473e-10 6.731156000000001e-11 ] [ -1.005892e-11 2.1458299e-10 2.2850381e-10 ] [ 3.0421728e-10 2.937771e-11 2.1936874e-10 ] [ 2.5620049e-10 1.9419852e-10 8.060477000000001e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.1572968 -0.85024 0.2207581 ] [ 1.1255113 -0.4684021 0.2737697 ] [ -0.3447989 0.4869597 -0.204952 ] [ -0.0154484 0.699659 -0.738711 ] [ -0.6079672 0.1320233 0.4491353 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.520172554866534e-10 -1.362234650068992e-09 3.536934666722285e-10 ] [ 1.803267891306215e-09 -7.504628937536237e-10 4.386274128234298e-10 ] [ -5.524287364575571e-10 7.801954466117817e-10 -3.283693027862016e-10 ] [ -2.475106530876672e-11 1.120977292332307e-09 -1.183545493727789e-09 ] [ -9.740708340532378e-10 2.115246446608647e-10 7.195940772359943e-10 ] ] } "relaxed-potential-energy" { "source-value" -9.4331327 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.511354467284398e-18 } }