{ "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" [ [ 2.743053 2.538085 1.844122 ] [ 1.813323 2.641816 4.57084 ] [ 2.418782 4.209438 3.124504 ] [ 4.81693 2.098767 1.448798 ] [ 3.906107 2.029734 3.728536 ] [ 4.411251 4.516232 1.926861 ] [ 3.723923 4.053892 4.839487 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.743053e-10 2.538085e-10 1.844122e-10 ] [ 1.813323e-10 2.641816e-10 4.57084e-10 ] [ 2.418782e-10 4.209438e-10 3.124504e-10 ] [ 4.81693e-10 2.098767e-10 1.448798e-10 ] [ 3.906107e-10 2.029734e-10 3.728536e-10 ] [ 4.411251e-10 4.516232e-10 1.926861e-10 ] [ 3.723923e-10 4.053892e-10 4.839487000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.5089189 -2.9373763 -4.4535829 ] [ -3.0460451 -2.5607569 2.5533108 ] [ -3.2241339 6.9635635 -2.3496502 ] [ 3.1695141 0.4365214 -0.5830698 ] [ 3.1329279 -3.562654 2.1534458 ] [ 1.195803 0.1971845 -0.2451063 ] [ 3.2808529 1.4635179 2.9246525 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.224084446663253e-09 -4.706195634352006e-09 -7.135426401174664e-09 ] [ -4.880302245122398e-09 -4.102784836732283e-09 4.090854869396145e-09 ] [ -5.165631956908726e-09 1.115685863715622e-08 -3.764554617498044e-09 ] [ 5.078121390315953e-09 6.993843815588851e-10 -9.341808018545317e-10 ] [ 5.01950383603204e-09 -5.708000946799603e-09 3.450200514919953e-09 ] [ 1.915887609682502e-09 3.159243958841376e-10 -3.92703583470791e-10 ] [ 5.25650581266388e-09 2.344814163502313e-09 4.685809859464273e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.340027 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.778178586344076e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1494777 2.258349 1.5010006 ] [ 1.8426343 2.3758072 3.9293413 ] [ 2.0114558 4.4364311 2.615318 ] [ 4.4152952 2.356286 1.9456566 ] [ 4.0922612 1.9616906 4.2750342 ] [ 4.3132782 4.6594923 2.5546769 ] [ 5.0089664 4.0399077 4.6621205 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1494777e-10 2.258349e-10 1.5010006e-10 ] [ 1.8426343e-10 2.3758072e-10 3.9293413e-10 ] [ 2.0114558e-10 4.4364311e-10 2.615318e-10 ] [ 4.4152952e-10 2.356286e-10 1.9456566e-10 ] [ 4.0922612e-10 1.9616906e-10 4.275034200000001e-10 ] [ 4.3132782e-10 4.6594923e-10 2.5546769e-10 ] [ 5.0089664e-10 4.0399077e-10 4.6621205e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.62e-05 -5.8e-06 -1.26e-05 ] [ 1.45e-05 5.9e-06 1.4e-06 ] [ -9.2e-06 2.43e-05 -5e-06 ] [ 2.01e-05 -1e-06 -2.57e-05 ] [ 1.06e-05 2.55e-05 9.9e-06 ] [ -1.1e-06 -6.09e-05 7.16e-05 ] [ -1.87e-05 1.2e-05 -3.95e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.595526125696e-14 -9.292624400640001e-15 -2.018742542208e-14 ] [ 2.32315610016e-14 9.45284206272e-15 2.24304726912e-15 ] [ -1.474002491136e-14 3.893289188544e-14 -8.010883104e-15 ] [ 3.220375007808e-14 -1.6021766208e-15 -4.117593915456e-14 ] [ 1.698307218048e-14 4.08555038304e-14 1.586154854592e-14 ] [ -1.76239428288e-15 -9.757255620672e-14 1.1471584604928e-13 ] [ -2.996070280896e-14 1.92261194496e-14 -6.32859765216e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.541842 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.611601224216751e-18 } }