{ "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" [ [ 0.9312002 0.7437347 1.637203 ] [ 0.2868751 2.587784 1.486301 ] [ 2.468756 0.0419283 1.950884 ] [ 2.101698 2.93019 0.1307908 ] [ 2.374683 2.856414 2.678274 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.312002000000001e-11 7.437347e-11 1.637203e-10 ] [ 2.868751e-11 2.587784e-10 1.486301e-10 ] [ 2.468756e-10 4.19283e-12 1.950884e-10 ] [ 2.101698e-10 2.93019e-10 1.307908e-11 ] [ 2.374683e-10 2.856414e-10 2.678274e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -13.7575151 -7.4662501 -1.8117543 ] [ -6.3322206 5.8691507 -0.33638 ] [ 12.0655944 -6.0309187 2.4490979 ] [ 3.134615 3.3604056 -5.7171171 ] [ 4.8895262 4.2676125 5.4161535 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.204196905352298e-08 -1.196225135526566e-08 -2.90275038209387e-09 ] [ -1.014533580306815e-08 9.403416035491955e-09 -5.38940171704704e-10 ] [ 1.933121326373541e-08 -9.662596943085528e-09 3.923887397430376e-09 ] [ 5.022206868208992e-09 5.383963288725396e-09 -9.159831355995895e-09 ] [ 7.833884564429065e-09 6.83746897413384e-09 8.677634512364093e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 1.5345197 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.45857158749703e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.3177908 0.3203678 1.7423969 ] [ -0.0685555 2.3850224 0.6593612 ] [ 2.5211562 0.3448161 2.5965702 ] [ 1.8962502 3.6852555 0.8436634 ] [ 3.4965706 2.4245891 2.0414612 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.177908e-11 3.203678e-11 1.7423969e-10 ] [ -6.855550000000001e-12 2.3850224e-10 6.593612e-11 ] [ 2.5211562e-10 3.448161000000001e-11 2.5965702e-10 ] [ 1.8962502e-10 3.6852555e-10 8.436634e-11 ] [ 3.4965706e-10 2.4245891e-10 2.0414612e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.09e-05 -1.5e-06 3.7e-06 ] [ 2.91e-05 -9.2e-06 -4.3e-06 ] [ 8.7e-06 9.2e-06 7.3e-06 ] [ -1.56e-05 2.79e-05 6.2e-06 ] [ -1.13e-05 -2.64e-05 -1.29e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.746372516672e-14 -2.4032649312e-15 5.928053496960001e-15 ] [ 4.662333966527999e-14 -1.474002491136e-14 -6.889359469440001e-15 ] [ 1.393893660096e-14 1.474002491136e-14 1.169588933184e-14 ] [ -2.499395528448e-14 4.470072772032e-14 9.93349504896e-15 ] [ -1.810459581504e-14 -4.229746278912e-14 -2.066807840832e-14 ] ] } "relaxed-potential-energy" { "source-value" -7.0960126 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.136906548862222e-18 } }