{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.8670835 0.0748596 0.0624467 ] [ 1.077368 0.92169 1.864842 ] [ 2.976718 2.979813 0.7013645 ] [ 1.541867 2.360612 1.695051 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.670835000000001e-11 7.48596e-12 6.24467e-12 ] [ 1.077368e-10 9.216900000000001e-11 1.864842e-10 ] [ 2.976718e-10 2.979813e-10 7.013645e-11 ] [ 1.541867e-10 2.360612e-10 1.695051e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.2672266 -1.4873109 -6.2430417 ] [ -17.3397084 -53.1365386 14.435349 ] [ 12.0131939 5.0976733 -8.3302699 ] [ 5.5937412 49.5261762 0.1379625 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.281442145032643e-10 -2.38293477147351e-09 -1.000245553682764e-08 ] [ -2.778127563885352e-08 -8.513412055655906e-08 2.312797887143526e-08 ] [ 1.924725856629133e-08 8.167373049025672e-09 -1.334656378869351e-08 ] [ 8.96216144728312e-09 7.93496822790069e-08 2.21040293868225e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 8.788002 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.407993146394527e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.85917 0.0332622 -0.1286759 ] [ 0.9519777 0.4943351 2.136185 ] [ 3.263743 3.0661055 0.5006948 ] [ 1.3881459 2.7432718 1.8155002 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.5917e-11 3.32622e-12 -1.286759e-11 ] [ 9.519777000000001e-11 4.943351000000001e-11 2.136185e-10 ] [ 3.263743e-10 3.0661055e-10 5.006948e-11 ] [ 1.3881459e-10 2.7432718e-10 1.8155002e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2e-07 -7e-07 -3.7e-06 ] [ 1e-07 2e-07 3.7e-06 ] [ -3.1e-06 -5e-07 2.2e-06 ] [ 3.2e-06 1e-06 -2.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.204353268e-16 -1.1215236438e-15 -5.9280535458e-15 ] [ 1.602176634e-16 3.204353268e-16 5.9280535458e-15 ] [ -4.9667475654e-15 -8.010883169999999e-16 3.5247885948e-15 ] [ 5.1269652288e-15 1.602176634e-15 -3.5247885948e-15 ] ] } "relaxed-potential-energy" { "source-value" -7.8710619 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.261083146094764e-18 } }