{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.990348 2.100415 1.411886 ] [ 2.946969 3.752547 2.888488 ] [ 5.496135 2.06422 2.457996 ] [ 4.937229 4.674633 2.559339 ] [ 4.468449 3.37128 4.359326 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.990348e-10 2.100415e-10 1.411886e-10 ] [ 2.946969e-10 3.752547e-10 2.888488e-10 ] [ 5.496135e-10 2.06422e-10 2.457996e-10 ] [ 4.937229e-10 4.674633e-10 2.559339e-10 ] [ 4.468449e-10 3.37128e-10 4.359326000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.607463 -1.163407 -0.7625968 ] [ -4.9007516 1.086481 -1.1688476 ] [ -0.7593345 0.497746 0.5018603 ] [ 2.3042192 1.6577241 -1.5090153 ] [ 2.748404 -2.0785442 2.9385995 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.732630166010303e-10 -1.863983495875066e-09 -1.221814764056894e-09 ] [ -7.851869637868194e-09 1.740734457143405e-09 -1.87270029799819e-09 ] [ -1.216587983266858e-09 7.974770042967168e-10 8.040688395676744e-10 ] [ 3.691766131438479e-09 2.655966796756722e-09 -2.417709034089498e-09 ] [ 4.403428633313204e-09 -3.330194922539439e-09 4.70815541679457e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.377239 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.822834633505397e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.2128063 2.0641414 1.4931432 ] [ 2.7125878 3.8995272 2.879205 ] [ 5.3627637 2.1279748 2.427043 ] [ 4.9919764 4.6429699 2.485371 ] [ 4.5589958 3.2284817 4.3922728 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.2128063e-10 2.0641414e-10 1.4931432e-10 ] [ 2.7125878e-10 3.8995272e-10 2.879205e-10 ] [ 5.362763700000001e-10 2.1279748e-10 2.427043e-10 ] [ 4.9919764e-10 4.6429699e-10 2.485371e-10 ] [ 4.5589958e-10 3.2284817e-10 4.3922728e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.1066169 -0.0567131 0.0751248 ] [ 0.6240963 -0.1257775 0.1849468 ] [ -0.0748224 0.7816098 -0.0812811 ] [ 0.031933 -0.6151987 -0.0949306 ] [ -0.47459 0.0160795 -0.0838599 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.708191045621715e-10 -9.086440291309249e-11 1.203631982022758e-10 ] [ 9.999125009877832e-10 -2.01517769922672e-10 2.963174390517734e-10 ] [ -1.198786999921459e-10 1.252276948148164e-09 -1.302266781329069e-10 ] [ 5.11623060320064e-11 -9.85656974286553e-10 -1.520955879185165e-10 ] [ -7.60377002465472e-10 2.57621989741536e-11 -1.343583712026259e-10 ] ] } "relaxed-potential-energy" { "source-value" -14.114932 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.261461405458178e-18 } }