{ "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" [ [ 0.635409 0.2945373 0.4894103 ] [ 0.6913641 0.4672635 2.355287 ] [ 2.952385 0.4157679 2.192681 ] [ 2.385934 1.774442 0.4759126 ] [ 2.093707 2.943435 1.550224 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.35409e-11 2.945373e-11 4.894103e-11 ] [ 6.913641e-11 4.672635e-11 2.355287e-10 ] [ 2.952385e-10 4.157679e-11 2.192681e-10 ] [ 2.385934000000001e-10 1.774442e-10 4.759126e-11 ] [ 2.093707e-10 2.943435e-10 1.550224e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.1808357 -0.7570036 -15.4367262 ] [ 0.8067356 3.2435451 16.0673491 ] [ -2.0208188 2.4858279 -3.1683978 ] [ 7.9952152 -36.6246794 -30.1491923 ] [ -8.9619678 31.6523101 32.6869671 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.494083972346002e-09 -1.212853469781435e-09 -2.473236181933083e-08 ] [ 1.292532917487061e-09 5.196732127730399e-09 2.574273108625192e-08 ] [ -3.237708636233111e-09 3.98273534471236e-09 -5.076332880554155e-09 ] [ 1.28097468717048e-08 -5.867920507897537e-08 -4.830433103906338e-08 ] [ -1.435865528552241e-08 5.071259123653171e-08 5.237029449247877e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -3.2694965 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.238310854087428e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.9914295 -0.1433985 0.4716209 ] [ 0.5681016 1.088313 2.3924571 ] [ 2.7279571 0.4666115 1.9419171 ] [ 2.2934972 1.738373 0.0849476 ] [ 2.1778137 2.7455467 2.1725722 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.914295e-11 -1.433985e-11 4.716209e-11 ] [ 5.681016e-11 1.088313e-10 2.3924571e-10 ] [ 2.7279571e-10 4.666115e-11 1.9419171e-10 ] [ 2.2934972e-10 1.738373e-10 8.494760000000001e-12 ] [ 2.1778137e-10 2.7455467e-10 2.1725722e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.8e-06 -3e-07 -6.26e-05 ] [ 3.25e-05 7.1e-06 3.6e-05 ] [ -2.06e-05 -2.8e-06 -2.1e-06 ] [ -9.9e-06 -3.42e-05 5.12e-05 ] [ -8.7e-06 3.02e-05 -2.26e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.089480102144e-14 -4.8065298624e-16 -1.0029625646208e-13 ] [ 5.207074017599999e-14 1.137545400768e-14 5.76783583488e-14 ] [ -3.300483838848e-14 -4.48609453824e-15 -3.36457090368e-15 ] [ -1.586154854592e-14 -5.479444043136e-14 8.203144298496001e-14 ] [ -1.393893660096e-14 4.838573394816e-14 -3.620919163008e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.467452 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.279247308174621e-18 } }