{ "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" [ [ 2.930378 5.180054 2.851976 ] [ 5.738994 3.052967 1.218676 ] [ 3.217774 2.94037 2.40806 ] [ 5.439965 2.572298 3.526756 ] [ 4.050256 4.656384 1.057411 ] [ 5.133306 4.977378 3.451883 ] [ 3.497867 4.079859 4.731393 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.930378e-10 5.180054e-10 2.851976e-10 ] [ 5.738994e-10 3.052967000000001e-10 1.218676e-10 ] [ 3.217774e-10 2.94037e-10 2.40806e-10 ] [ 5.439965e-10 2.572298e-10 3.526756e-10 ] [ 4.050256e-10 4.656384e-10 1.057411e-10 ] [ 5.133306e-10 4.977378e-10 3.451883e-10 ] [ 3.497867e-10 4.079859e-10 4.731393e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.1092602 7.7279847 -0.0656947 ] [ 4.2675519 -2.0752941 -3.6945416 ] [ -9.3509779 -12.2839299 -3.2082218 ] [ 3.6452655 -3.8858373 1.1131496 ] [ 1.1554384 2.5205241 -9.0713235 ] [ 11.3994247 8.8682008 5.4704361 ] [ -3.0074424 -0.8716483 9.456196 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.299246710442393e-08 1.23815964122401e-08 -1.052545124504698e-10 ] [ 6.83737188223062e-09 -3.324987688304177e-09 -5.919308176093025e-09 ] [ -1.498191817299748e-08 -1.968102529732608e-08 -5.140137962300893e-09 ] [ 5.840359160708822e-09 -6.225797674292596e-09 1.783462264572872e-09 ] [ 1.851216391254559e-09 4.038324785182961e-09 -1.453386243141363e-08 ] [ 1.826389174491005e-08 1.420842399031986e-08 8.76460482500033e-09 ] [ -4.818453901682642e-09 -1.396534527820065e-09 1.515049615290248e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -1.856531 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.974490563990445e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.9525319 5.8326832 2.3751721 ] [ 5.7547613 3.7029154 0.9148714 ] [ 3.3208325 2.5194639 2.9421885 ] [ 5.7501396 2.6095557 3.0298568 ] [ 3.3880238 3.9540641 0.9788348 ] [ 5.5960488 4.3280133 4.6705208 ] [ 3.2462021 4.5126144 4.3347106 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.9525319e-10 5.832683200000001e-10 2.3751721e-10 ] [ 5.7547613e-10 3.702915400000001e-10 9.148714e-11 ] [ 3.3208325e-10 2.5194639e-10 2.9421885e-10 ] [ 5.7501396e-10 2.6095557e-10 3.0298568e-10 ] [ 3.3880238e-10 3.9540641e-10 9.788348000000001e-11 ] [ 5.5960488e-10 4.3280133e-10 4.6705208e-10 ] [ 3.2462021e-10 4.512614400000001e-10 4.3347106e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5e-06 1e-05 -5.9e-06 ] [ 1.03e-05 5.4e-06 1.9e-06 ] [ -7.5e-06 -1.01e-05 -3.2e-06 ] [ 4.3e-06 -1e-07 -4.4e-06 ] [ -1.12e-05 -6.9e-06 9.6e-06 ] [ -7.2e-06 1.7e-06 -8e-07 ] [ 6.3e-06 1e-07 2.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.010883104e-15 1.6021766208e-14 -9.45284206272e-15 ] [ 1.650241919424e-14 8.65175375232e-15 3.04413557952e-15 ] [ -1.2016324656e-14 -1.618198387008e-14 -5.126965186560001e-15 ] [ 6.889359469440001e-15 -1.6021766208e-16 -7.04957713152e-15 ] [ -1.794437815296e-14 -1.105501868352e-14 1.538089555968e-14 ] [ -1.153567166976e-14 2.72370025536e-15 -1.28174129664e-15 ] [ 1.009371271104e-14 1.6021766208e-16 4.48609453824e-15 ] ] } "relaxed-potential-energy" { "source-value" -12.040115 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.929039076474339e-18 } }