{ "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" [ [ 1.422927 0.2017469 2.232361 ] [ 0.633062 2.288682 0.1533226 ] [ 0.4085169 2.174523 2.673779 ] [ 1.949891 1.221121 0.2190205 ] [ 2.589215 1.862387 2.264415 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.422927e-10 2.017469e-11 2.232361e-10 ] [ 6.33062e-11 2.288682e-10 1.533226e-11 ] [ 4.085169000000001e-11 2.174523e-10 2.673779e-10 ] [ 1.949891e-10 1.221121e-10 2.190205e-11 ] [ 2.589215e-10 1.862387e-10 2.264415e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.6506826 -15.0116614 6.3386489 ] [ -15.7576875 13.1235051 -9.7305654 ] [ -9.901289 6.4573533 8.3926357 ] [ 13.5747654 -10.1253562 -12.7632997 ] [ 13.7348937 5.5561593 7.7625805 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.644685070081358e-09 -2.40513329344458e-08 1.015563507503964e-08 ] [ -2.52465985103724e-08 2.102617305416956e-08 -1.55900843910454e-08 ] [ -1.586361375158421e-08 1.034582048950573e-08 1.344648470543144e-08 ] [ 2.174917175672476e-08 -1.622260898091233e-08 -2.044906038360365e-08 ] [ 2.200572557531321e-08 8.901948531900494e-09 1.243702499417798e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 6.2309626 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 9.983102602799183e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.950211 -0.249772 2.0722476 ] [ 0.292119 2.4639606 0.2070955 ] [ 0.4651179 2.1700791 2.7413494 ] [ 2.3363405 0.9292958 0.2758176 ] [ 2.9598235 2.4348965 2.246388 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.50211e-11 -2.49772e-11 2.0722476e-10 ] [ 2.92119e-11 2.4639606e-10 2.070955e-11 ] [ 4.651179e-11 2.1700791e-10 2.7413494e-10 ] [ 2.3363405e-10 9.292958e-11 2.758176e-11 ] [ 2.9598235e-10 2.4348965e-10 2.246388e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.73e-05 3.8e-06 1.5e-06 ] [ 3.4e-06 -7.9e-06 -2.2e-06 ] [ -6.5e-06 -3.6e-06 -2.71e-05 ] [ -3.57e-05 2.17e-05 2.12e-05 ] [ 2.14e-05 -1.4e-05 6.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.771765553984e-14 6.08827115904e-15 2.4032649312e-15 ] [ 5.44740051072e-15 -1.265719530432e-14 -3.52478856576e-15 ] [ -1.04141480352e-14 -5.76783583488e-15 -4.341898642368e-14 ] [ -5.719770536256001e-14 3.476723267136e-14 3.396614436096001e-14 ] [ 3.428657968511999e-14 -2.24304726912e-14 1.04141480352e-14 ] ] } "relaxed-potential-energy" { "source-value" -6.4498528 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.033380336376142e-18 } }