{ "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" [ [ 1.152391 0.2084818 1.476287 ] [ 0.2004725 1.985654 1.37487 ] [ 0.8976264 2.29727 2.845471 ] [ 1.752289 1.001076 2.997864 ] [ 1.785348 1.533822 0.3428561 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.152391e-10 2.084818e-11 1.476287e-10 ] [ 2.004725e-11 1.985654e-10 1.37487e-10 ] [ 8.976264000000001e-11 2.29727e-10 2.845471e-10 ] [ 1.752289e-10 1.001076e-10 2.997864e-10 ] [ 1.785348e-10 1.533822e-10 3.428561e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.8923757 -30.6472929 -5.5628721 ] [ -31.134042 8.1645759 -24.9389352 ] [ -11.2253307 44.619546 25.8479505 ] [ 32.4764406 -30.9007616 23.5101035 ] [ 15.7753078 8.7639325 -18.8562467 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.440626665289392e-09 -4.910237657973409e-08 -8.91270369655051e-09 ] [ -4.988223461437462e-08 1.308109273349952e-08 -3.995657925428011e-08 ] [ -1.798496255646286e-08 7.148839402088815e-08 4.141298232788861e-08 ] [ 5.203299428480892e-08 -4.950847820832445e-08 3.766733849062161e-08 ] [ 2.527482955131794e-08 1.40413678734532e-08 -3.021103786767961e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 24.114034 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.863494182628155e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0775397 -0.292634 1.3875227 ] [ 0.2287663 2.9589802 1.0146216 ] [ 0.598007 2.5987762 3.2798095 ] [ 1.7406137 0.5891701 3.510272 ] [ 1.1432002 1.1720113 -0.1548777 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0775397e-10 -2.92634e-11 1.3875227e-10 ] [ 2.287663e-11 2.9589802e-10 1.0146216e-10 ] [ 5.980069999999999e-11 2.5987762e-10 3.2798095e-10 ] [ 1.7406137e-10 5.891701000000001e-11 3.510272e-10 ] [ 1.1432002e-10 1.1720113e-10 -1.548777e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.43e-05 9.3e-06 -2.48e-05 ] [ 1.33e-05 6.8e-06 -2.99e-05 ] [ 8.8e-06 -2.33e-05 2.48e-05 ] [ -1.62e-05 1.6e-05 2.95e-05 ] [ -2.01e-05 -8.9e-06 3e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.29111258662e-14 1.49002426962e-14 -3.97339805232e-14 ] [ 2.13089492322e-14 1.08948011112e-14 -4.790508135659999e-14 ] [ 1.40991543792e-14 -3.733071557219999e-14 3.97339805232e-14 ] [ -2.59552614708e-14 2.5634826144e-14 4.726421070299999e-14 ] [ -3.22037503434e-14 -1.42593720426e-14 4.806529901999999e-16 ] ] } "relaxed-potential-energy" { "source-value" -12.435336 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.992360477513902e-18 } }