{ "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" [ [ 2.875077 1.739271 0.5500127 ] [ 2.247142 4.095662 1.890424 ] [ 4.370849 2.938246 1.693427 ] [ 3.902852 1.049683 3.036341 ] [ 5.923496 0.662055 4.457524 ] [ 5.031061 2.817229 4.209838 ] [ 4.680107 5.055758 2.976326 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.875077e-10 1.739271e-10 5.500127000000001e-11 ] [ 2.247142e-10 4.095662e-10 1.890424e-10 ] [ 4.370849e-10 2.938246e-10 1.693427e-10 ] [ 3.902852e-10 1.049683e-10 3.036341e-10 ] [ 5.923496e-10 6.62055e-11 4.457524e-10 ] [ 5.031061e-10 2.817229e-10 4.209838000000001e-10 ] [ 4.680106999999999e-10 5.055758e-10 2.976326e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.0094638 -0.4442556 1.8588623 ] [ 2.9896358 -0.1601607 0.4974151 ] [ 1.9767272 1.7890574 0.1802806 ] [ -1.6407844 -1.6041801 -2.0915467 ] [ 0.1507422 -0.9361316 -0.0087546 ] [ 0.2040053 2.9198945 0.1419043 ] [ -2.6708623 -1.5642238 -0.578161 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.617339313228849e-09 -7.117759418436503e-10 2.978225742883498e-09 ] [ 4.789924622929896e-09 -2.566057312250838e-10 7.969468506187733e-10 ] [ 3.167066131632244e-09 2.866385963164791e-09 2.888413648835004e-10 ] [ -2.628826427111709e-09 -2.570179872947783e-09 -3.351027251659807e-09 ] [ 2.415156305977548e-10 -1.499848175869034e-09 -1.40264155600164e-11 ] [ 3.268525248721602e-10 4.678186741645112e-09 2.273557537241262e-10 ] [ -4.279193169691498e-09 -2.506162822706689e-09 -9.263160448900739e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -20.719185 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.319579408252329e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5967789 1.7030268 1.4731552 ] [ 2.3822088 4.1097418 1.8143214 ] [ 4.8003828 3.1396641 1.3498396 ] [ 4.6947697 0.8534432 2.3723588 ] [ 4.6559306 1.0221948 4.7627293 ] [ 5.7416519 2.849118 3.6548504 ] [ 4.1588612 4.6807153 3.386638 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5967789e-10 1.7030268e-10 1.4731552e-10 ] [ 2.3822088e-10 4.1097418e-10 1.8143214e-10 ] [ 4.8003828e-10 3.1396641e-10 1.3498396e-10 ] [ 4.694769700000001e-10 8.534432e-11 2.372358800000001e-10 ] [ 4.6559306e-10 1.0221948e-10 4.762729300000001e-10 ] [ 5.7416519e-10 2.849118e-10 3.6548504e-10 ] [ 4.1588612e-10 4.6807153e-10 3.386638e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.87e-05 9.03e-05 -1.23e-05 ] [ 7.2e-06 -6.63e-05 -7.16e-05 ] [ -7.03e-05 -0.0001076 -7.76e-05 ] [ -5.97e-05 5.27e-05 6.61e-05 ] [ 2.62e-05 5.4e-06 -7.05e-05 ] [ 0.0001476 -5.5e-05 6.14e-05 ] [ -8.96e-05 8.04e-05 0.0001046 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.200423573579999e-14 1.446765500502e-13 -1.97067725982e-14 ] [ 1.15356717648e-14 -1.062243108342e-13 -1.147158469944e-13 ] [ -1.126330173702e-13 -1.723942058184e-13 -1.243289067984e-13 ] [ -9.56499450498e-14 8.44347086118e-14 1.059038755074e-13 ] [ 4.197702781079999e-14 8.6517538236e-15 -1.12953452697e-13 ] [ 2.364812711784e-13 -8.811971486999999e-14 9.83736453276e-14 ] [ -1.435550264064e-13 1.288150013736e-13 1.675876759164e-13 ] ] } "relaxed-potential-energy" { "source-value" -23.518896 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.768142562867607e-18 } }