{ "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" [ [ 0.1724043 0.1217148 2.355607 ] [ 0.0803944 1.628444 0.6781111 ] [ 0.0194903 2.198586 2.964695 ] [ 2.614645 0.684385 2.185781 ] [ 2.191382 2.601245 1.67848 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.724043e-11 1.217148e-11 2.355607e-10 ] [ 8.03944e-12 1.628444e-10 6.781111e-11 ] [ 1.94903e-12 2.198586e-10 2.964695e-10 ] [ 2.614645e-10 6.84385e-11 2.185781e-10 ] [ 2.191382e-10 2.601245e-10 1.67848e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.1932468 -4.1379025 1.0397645 ] [ -2.4026788 0.9118571 -3.9723789 ] [ -2.6159481 2.8558516 2.976 ] [ 4.1074958 -4.1367963 1.1619702 ] [ 2.104378 4.5069901 -1.2053558 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.911792125804414e-09 -6.629650644649873e-09 1.665886373037801e-09 ] [ -3.849515800651799e-09 1.460956127130488e-09 -6.364452602539221e-09 ] [ -4.191210887046181e-09 4.575578665994273e-09 4.7680776235008e-09 ] [ 6.580933740794193e-09 -6.627878316871943e-09 1.8616814885063e-09 ] [ 3.371585232925863e-09 7.220994168397055e-09 -1.931192882505681e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.6402223 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.54453387883748e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.1669496 0.1109511 2.2494413 ] [ 0.1197601 1.6444601 0.3213122 ] [ 0.0739144 2.180105 3.441969 ] [ 2.587228 0.5208729 2.46336 ] [ 2.1304639 2.7779857 1.3865916 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.669496e-11 1.109511e-11 2.2494413e-10 ] [ 1.197601e-11 1.6444601e-10 3.213122e-11 ] [ 7.39144e-12 2.180105e-10 3.441969e-10 ] [ 2.587228e-10 5.208729e-11 2.46336e-10 ] [ 2.1304639e-10 2.7779857e-10 1.3865916e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.84e-05 -1.58e-05 -2.78e-05 ] [ -1e-05 3.9e-05 1.41e-05 ] [ -4.24e-05 1.46e-05 2.45e-05 ] [ 8.64e-05 -1.11e-05 3.57e-05 ] [ -5.6e-06 -2.67e-05 -4.66e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.550181603071999e-14 -2.531439060864e-14 -4.454051005824e-14 ] [ -1.6021766208e-14 6.248488821120001e-14 2.259069035328e-14 ] [ -6.793228872192001e-14 2.339177866368e-14 3.92533272096e-14 ] [ 1.3842806003712e-13 -1.778416049088e-14 5.719770536256001e-14 ] [ -8.972189076479999e-15 -4.277811577536e-14 -7.466143052928e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.809519 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.052311186549339e-18 } }