{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.438828 2.90963 1.106787 ] [ 1.47463 4.835343 1.863436 ] [ 2.314132 3.251036 2.795551 ] [ 3.696872 4.248886 0.9164855 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.38828e-11 2.90963e-10 1.106787e-10 ] [ 1.47463e-10 4.835343e-10 1.863436e-10 ] [ 2.314132e-10 3.251036e-10 2.795551e-10 ] [ 3.696872e-10 4.248886e-10 9.164855e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.2688497 -0.0387607 0.4398253 ] [ -1.4295136 3.9040696 -2.6506376 ] [ 2.0871371 -3.8101501 1.3292715 ] [ -0.9264732 -0.0551588 0.8815408 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.307447073979098e-10 -6.21014878574838e-11 7.046778187020401e-10 ] [ -2.290333287905222e-09 6.255009090629725e-09 -4.246789627921838e-09 ] [ 3.343962293574521e-09 -6.104533462252763e-09 2.129727737542131e-09 ] [ -1.484373713067209e-09 -8.83741405194792e-11 1.412384071677667e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.4760942 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.358020007482292e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.4890489 3.1595422 1.7569334 ] [ 1.3567027 5.1492056 0.9790204 ] [ 2.6055281 2.4732429 2.3621118 ] [ 3.4731823 4.4629043 1.584194 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.890489000000001e-11 3.1595422e-10 1.7569334e-10 ] [ 1.3567027e-10 5.1492056e-10 9.790204000000001e-11 ] [ 2.6055281e-10 2.4732429e-10 2.3621118e-10 ] [ 3.4731823e-10 4.4629043e-10 1.584194e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.27e-05 6.1e-06 -2e-07 ] [ -4.1e-06 4e-06 -3.1e-06 ] [ 2.2e-06 -3.4e-06 1.1e-06 ] [ -1.08e-05 -6.7e-06 2.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.03476432518e-14 9.773277467399999e-15 -3.204353268e-16 ] [ -6.568924199399999e-15 6.408706535999999e-15 -4.9667475654e-15 ] [ 3.5247885948e-15 -5.4474005556e-15 1.7623942974e-15 ] [ -1.73035076472e-14 -1.07345834478e-14 3.685006258199999e-15 ] ] } "relaxed-potential-energy" { "source-value" -9.6673908 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.548886765150656e-18 } }