{ "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" [ [ 0.2609343 1.090408 2.782185 ] [ 0.9561081 2.831858 1.606096 ] [ 1.573969 0.2926919 1.087299 ] [ 2.9831 1.515461 0.0011433 ] [ 2.828068 2.074027 2.745594 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.609343e-11 1.090408e-10 2.782185e-10 ] [ 9.561081000000001e-11 2.831858e-10 1.606096e-10 ] [ 1.573969e-10 2.926919e-11 1.087299e-10 ] [ 2.9831e-10 1.515461e-10 1.1433e-13 ] [ 2.828068e-10 2.074027e-10 2.745594e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.041771 -0.6361782 2.6898275 ] [ -0.1513212 2.0007783 -2.0683073 ] [ -0.7711038 -1.4896375 1.0797115 ] [ 1.9979869 2.7611514 2.2812452 ] [ -1.033791 -2.636114 -3.9824768 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.69245196274368e-11 -1.019269838702627e-09 4.309578734484912e-09 ] [ -2.424432888714009e-10 3.205600215663968e-09 -3.313793600689972e-09 ] [ -1.235444480570039e-09 -2.38666237596696e-09 1.729888522508899e-09 ] [ 3.201127899844667e-09 4.42385221956919e-09 3.65495772575222e-09 ] [ -1.656315770993453e-09 -4.223520220563571e-09 -6.380631221838398e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.904648 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.747117208365348e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.4023684 1.2204791 3.0661405 ] [ 0.9227307 2.7386333 1.1868955 ] [ 1.4511324 0.2076933 1.0707734 ] [ 3.0385034 1.9012993 0.2227863 ] [ 2.7874445 1.7363409 2.6757215 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.023684000000001e-11 1.2204791e-10 3.0661405e-10 ] [ 9.227307000000001e-11 2.7386333e-10 1.1868955e-10 ] [ 1.4511324e-10 2.076933e-11 1.0707734e-10 ] [ 3.0385034e-10 1.9012993e-10 2.227863e-11 ] [ 2.7874445e-10 1.7363409e-10 2.6757215e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.8e-06 -3e-07 -9e-07 ] [ -3e-06 1.3e-06 1.5e-06 ] [ -3e-07 -5e-07 1.4e-06 ] [ 2.6e-06 -5e-07 1.6e-06 ] [ 2.5e-06 0.0 -3.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.88391791744e-15 -4.8065298624e-16 -1.44195895872e-15 ] [ -4.8065298624e-15 2.08282960704e-15 2.4032649312e-15 ] [ -4.8065298624e-16 -8.010883104e-16 2.24304726912e-15 ] [ 4.16565921408e-15 -8.010883104e-16 2.56348259328e-15 ] [ 4.005441552e-15 0.0 -5.76783583488e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.399219 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.146791541877916e-18 } }