{ "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" [ [ -0.774475 -1.1997967 0.2570399 ] [ 0.861906 -0.4558613 0.3455887 ] [ 1.7064205 2.5347584 3.4349885 ] [ 0.4774658 0.2193608 -0.3094848 ] [ -1.2105574 0.4346684 -0.6425896 ] [ -0.7717339 1.1410056 -2.9543657 ] [ -0.2890259 -2.6741351 -0.131177 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.24084574861715e-09 -1.922286238290308e-09 4.118233217856966e-10 ] [ 1.380925653904404e-09 -7.303703232048641e-10 5.536941401144357e-10 ] [ 2.733987052878597e-09 4.061130681315225e-09 5.503458312758709e-09 ] [ 7.649845482941172e-10 3.514547481755472e-10 -4.958493151381631e-10 ] [ -1.939526780395791e-09 6.964155540181655e-10 -1.029542042371406e-09 ] [ -1.236454022245693e-09 1.82809251158315e-09 -4.733415692831053e-09 ] [ -4.630705436008206e-10 -4.284436773379253e-09 -2.10168724318218e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -14.874119064916393 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.383096601714297e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.0813872 1.8083445 0.6920195 ] [ 2.2931805 3.232696 2.3866003 ] [ 4.628439 3.1746746 1.6675217 ] [ 3.7187621 1.2912251 2.8210512 ] [ 5.4158259 0.8420543 4.2388586 ] [ 4.8484724 3.0220424 4.0678602 ] [ 5.0445169 4.9868671 2.9399813 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.0813872e-10 1.8083445e-10 6.920195e-11 ] [ 2.2931805e-10 3.232696e-10 2.3866003e-10 ] [ 4.628439e-10 3.1746746e-10 1.6675217e-10 ] [ 3.7187621e-10 1.2912251e-10 2.8210512e-10 ] [ 5.4158259e-10 8.420543000000001e-11 4.2388586e-10 ] [ 4.8484724e-10 3.0220424e-10 4.067860200000001e-10 ] [ 5.0445169e-10 4.986867100000001e-10 2.9399813e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 9.72e-05 -5.45e-05 0.0001305 ] [ 0.0001078 -2e-06 -0.0001545 ] [ -0.000255 -0.0001455 0.0002404 ] [ -2.3e-06 0.0003857 -7.75e-05 ] [ 3.52e-05 -8.36e-05 -1.49e-05 ] [ 9.74e-05 -2.25e-05 -0.0001834 ] [ -8.03e-05 -7.76e-05 5.93e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.557315688248e-13 -8.7318626553e-14 2.09084050737e-13 ] [ 1.727146411452e-13 -3.204353268e-15 -2.47536289953e-13 ] [ -4.0855504167e-13 -2.33116700247e-13 3.851632628136e-13 ] [ -3.685006258199999e-15 6.179595277337999e-13 -1.24168689135e-13 ] [ 5.63966175168e-14 -1.339419666024e-13 -2.38724318466e-14 ] [ 1.560520041516e-13 -3.6048974265e-14 -2.938391946756e-13 ] [ -1.286547837102e-13 -1.243289067984e-13 9.500907439619998e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.502128064916388 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.964367726488467e-18 } }