{ "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" [ [ 0.9541135 0.9980995 1.487518 ] [ 0.5060444 0.4713921 2.728449 ] [ 2.547937 2.415228 0.679434 ] [ 2.841188 2.325305 2.080908 ] [ 1.503866 2.653234 2.3648 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.541135e-11 9.980995000000001e-11 1.487518e-10 ] [ 5.060444e-11 4.713921e-11 2.728449e-10 ] [ 2.547937e-10 2.415228e-10 6.79434e-11 ] [ 2.841188e-10 2.325305e-10 2.080908e-10 ] [ 1.503866e-10 2.653234e-10 2.3648e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.4830117 -8.7934474 -19.0785363 ] [ -12.4206758 -15.652267 18.9634874 ] [ 7.2901871 5.7105377 -28.6943099 ] [ 28.7462813 0.1897546 14.2940828 ] [ -17.1327809 18.5454221 14.515276 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.038692977811286e-08 -1.408865584051455e-08 -3.056718481894413e-08 ] [ -1.990011638129634e-08 -2.507769624991935e-08 3.038285616111538e-08 ] [ 1.168016733287775e-08 9.149289995137005e-09 -4.597335247176999e-08 ] [ 4.605661983380024e-08 3.040203838092557e-10 2.29016452779394e-08 ] [ -2.744974100726878e-08 2.971304171148764e-08 2.325603585165934e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 119.07222 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.907747270707542e-17 } "relaxed-configuration-positions" { "source-value" [ [ -1.7652609 -2.1581775 -2.6565673 ] [ -1.1817262 -2.6960081 7.3118939 ] [ 4.8389505 5.1897381 -4.2033459 ] [ 7.5125309 1.6982789 4.7798097 ] [ -1.0513454 6.8294272 4.1093187 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.7652609e-10 -2.1581775e-10 -2.6565673e-10 ] [ -1.1817262e-10 -2.6960081e-10 7.3118939e-10 ] [ 4.8389505e-10 5.189738099999999e-10 -4.203345900000001e-10 ] [ 7.5125309e-10 1.6982789e-10 4.7798097e-10 ] [ -1.0513454e-10 6.829427199999999e-10 4.109318700000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0 -0.0 -0.0 ] [ 0.0 -0.0 0.0 ] [ 0.0 0.0 -0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] } "relaxed-potential-energy" { "source-value" 3.5527137e-15 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.692074830535866e-34 } }