{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.912622 1.78272 1.2568 ] [ 2.727936 0.232034 3.207427 ] [ 3.003232 2.746828 4.7469 ] [ 4.479923 1.355966 2.983258 ] [ 4.230826 3.711883 2.275883 ] [ 5.441026 3.401037 4.285306 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.912622e-10 1.78272e-10 1.2568e-10 ] [ 2.727936e-10 2.32034e-11 3.207427e-10 ] [ 3.003232e-10 2.746828e-10 4.7469e-10 ] [ 4.479923e-10 1.355966e-10 2.983258e-10 ] [ 4.230826000000001e-10 3.711883e-10 2.275883e-10 ] [ 5.441026e-10 3.401037e-10 4.285306000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.3102825 -0.0764386 0.8484313 ] [ -3.1414264 -1.0092672 0.0479332 ] [ 1.1180356 -0.033042 -0.7420962 ] [ 3.5730314 1.923748 0.0253684 ] [ -0.6081851 -0.0515126 -0.0188686 ] [ -1.2517379 -0.7534876 -0.1607681 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.97127367343376e-10 -1.224681378466829e-10 1.359336793214951e-09 ] [ -5.033119934043909e-09 -1.617024311980278e-09 7.679745240013058e-11 ] [ 1.791290499542101e-09 -5.293911990447361e-11 -1.188969182024521e-09 ] [ 5.724627374464294e-09 3.082184069910759e-09 4.064465738710272e-11 ] [ -9.7441994833891e-10 -8.253228339662208e-11 -3.023082978722688e-11 ] [ -2.005505198749288e-09 -1.207220216782702e-09 -2.575788911904365e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -4.872195279081939 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.806117368117215e-19 } "relaxed-configuration-positions" { "source-value" [ [ 3.3780629 1.7984494 1.417624 ] [ 2.7385484 0.7714001 3.4097092 ] [ 2.9309404 2.8796736 4.5584179 ] [ 4.9925835 0.8829742 2.8273918 ] [ 3.5704546 3.9067228 2.5663321 ] [ 5.1849752 2.9912479 3.976099 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.3780629e-10 1.7984494e-10 1.417624e-10 ] [ 2.7385484e-10 7.714001000000001e-11 3.4097092e-10 ] [ 2.9309404e-10 2.8796736e-10 4.558417900000001e-10 ] [ 4.992583500000001e-10 8.829742e-11 2.8273918e-10 ] [ 3.5704546e-10 3.9067228e-10 2.5663321e-10 ] [ 5.1849752e-10 2.9912479e-10 3.976099e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.3e-06 -3e-07 -8e-07 ] [ -1.1e-06 2.2e-06 3.1e-06 ] [ 4.7e-06 -4.3e-06 2e-07 ] [ -7e-07 7e-07 -1.6e-06 ] [ -1e-07 2.1e-06 -4.4e-06 ] [ -4.2e-06 -3e-07 3.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.08282960704e-15 -4.8065298624e-16 -1.28174129664e-15 ] [ -1.76239428288e-15 3.52478856576e-15 4.96674752448e-15 ] [ 7.53023011776e-15 -6.889359469440001e-15 3.2043532416e-16 ] [ -1.12152363456e-15 1.12152363456e-15 -2.56348259328e-15 ] [ -1.6021766208e-16 3.36457090368e-15 -7.04957713152e-15 ] [ -6.72914180736e-15 -4.8065298624e-16 5.76783583488e-15 ] ] } "relaxed-potential-energy" { "source-value" -6.635338279081939 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.063098386184439e-18 } }