{ "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" [ [ 2.990348 2.100415 1.411886 ] [ 2.946969 3.752547 2.888488 ] [ 5.496135 2.06422 2.457996 ] [ 4.937229 4.674633 2.559339 ] [ 4.468449 3.37128 4.359326 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.990348e-10 2.100415e-10 1.411886e-10 ] [ 2.946969e-10 3.752547e-10 2.888488e-10 ] [ 5.496135e-10 2.06422e-10 2.457996e-10 ] [ 4.937229e-10 4.674633e-10 2.559339e-10 ] [ 4.468449e-10 3.37128e-10 4.359326000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.6541461 -14.3452871 -11.9165435 ] [ -54.6539133 11.4504194 -11.3773605 ] [ 0.0667175 -0.0859435 -1.178091 ] [ 29.3314692 24.5493592 -23.7320978 ] [ 23.6015805 -21.568548 48.2040927 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.650234208807499e-09 -2.298368361028383e-08 -1.90924073964462e-08 ] [ -8.756522212449017e-08 1.834559426103476e-08 -1.82285409995134e-08 ] [ 1.06893218698224e-10 -1.376966664097248e-10 -1.887509857374893e-09 ] [ 4.699419420595528e-08 3.93324093658614e-08 -3.802301225769911e-08 ] [ 3.781390049102917e-08 -3.45566233502026e-08 7.723147035081595e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -1.6049377 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.571393660780524e-19 } "relaxed-configuration-positions" { "source-value" [ [ 3.0602448 1.862192 1.4130815 ] [ 2.6870256 3.9358339 2.8570913 ] [ 5.4197077 2.1744406 2.3403756 ] [ 5.1498768 4.7953911 2.4654819 ] [ 4.5222751 3.1952374 4.6010047 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.0602448e-10 1.862192e-10 1.4130815e-10 ] [ 2.6870256e-10 3.9358339e-10 2.8570913e-10 ] [ 5.419707700000001e-10 2.1744406e-10 2.3403756e-10 ] [ 5.149876800000001e-10 4.7953911e-10 2.4654819e-10 ] [ 4.5222751e-10 3.1952374e-10 4.6010047e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.04e-05 -8.2e-06 -2.93e-05 ] [ -6.8e-06 -2.6e-05 2.3e-06 ] [ 1.7e-06 6e-07 1.5e-05 ] [ 2.47e-05 2.08e-05 3e-07 ] [ 1.09e-05 1.29e-05 1.17e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.870616927232e-14 -1.313784829056e-14 -4.694377498944e-14 ] [ -1.089480102144e-14 -4.16565921408e-14 3.68500622784e-15 ] [ 2.72370025536e-15 9.6130597248e-16 2.4032649312e-14 ] [ 3.957376253376001e-14 3.332527371264e-14 4.8065298624e-16 ] [ 1.746372516672e-14 2.066807840832e-14 1.874546646336e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.556674 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.652671600100722e-18 } }