{ "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" [ [ -2.4117042 -18.3037684 6.6238929 ] [ -12.802571 11.1240835 -11.1752129 ] [ -12.1450798 7.8151423 10.8475188 ] [ 10.9586882 -8.1091276 -14.449982 ] [ 16.4006668 7.4736701 8.1537831 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.863976085525167e-09 -2.932586980301782e-08 1.061264634306311e-08 ] [ -2.051197994233208e-08 1.782274651152704e-08 -1.790466484084257e-08 ] [ -1.945856291331034e-08 1.252123828128514e-08 1.737964101504847e-08 ] [ 1.755775402867683e-08 -1.299225465580402e-08 -2.315142333138082e-08 ] [ 2.627676491249075e-08 1.1974139505792e-08 1.306380065389415e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 91.665065 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.468636240871123e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.6505713 -4.5816635 4.0021342 ] [ -2.5227087 5.1805264 -3.2708693 ] [ -3.0248781 4.3249188 6.6797967 ] [ 5.1994987 -1.1051322 -4.1971542 ] [ 6.7011287 3.9298104 4.3289907 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.505713e-11 -4.581663500000001e-10 4.0021342e-10 ] [ -2.5227087e-10 5.1805264e-10 -3.2708693e-10 ] [ -3.0248781e-10 4.3249188e-10 6.6797967e-10 ] [ 5.199498700000001e-10 -1.1051322e-10 -4.1971542e-10 ] [ 6.7011287e-10 3.9298104e-10 4.328990700000001e-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 } }