{ "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" [ [ 0.4711414 1.535718 0.6051258 ] [ 0.1383881 2.176586 2.72717 ] [ 2.449817 0.7251628 0.0780297 ] [ 1.858809 0.1214998 2.575793 ] [ 2.444403 2.05802 2.37174 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.711414e-11 1.535718e-10 6.051258000000001e-11 ] [ 1.383881e-11 2.176586e-10 2.72717e-10 ] [ 2.449817e-10 7.251628e-11 7.80297e-12 ] [ 1.858809e-10 1.214998e-11 2.575793e-10 ] [ 2.444403e-10 2.05802e-10 2.37174e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.8166108 1.8735576 -10.6530746 ] [ -11.1422933 6.3397894 8.9806114 ] [ 8.6230799 -4.5376416 -11.2320896 ] [ 1.2101024 -15.0837499 7.9142165 ] [ 12.1257218 11.4080445 4.9903363 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.733012094005278e-08 3.001770184442158e-09 -1.706810706375831e-08 ] [ -1.785192182735648e-08 1.015746235747566e-08 1.438852562556996e-08 ] [ 1.38156970150704e-08 -7.270103285089505e-09 -1.799579135985082e-08 ] [ 1.93879777405397e-09 -2.416683144377434e-08 1.26799726482496e-08 ] [ 1.942754797828489e-08 1.827770218694603e-08 7.995400149789576e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 48.478675 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.767139969236146e-18 } "relaxed-configuration-positions" { "source-value" [ [ -1.1635585 1.7731855 -0.9884755 ] [ -1.3134143 2.9732931 4.3769028 ] [ 4.019699 -0.0210353 -1.3942012 ] [ 1.8455133 -1.5823794 3.4782497 ] [ 3.974319 3.4739226 2.8853827 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.1635585e-10 1.7731855e-10 -9.884755e-11 ] [ -1.3134143e-10 2.9732931e-10 4.3769028e-10 ] [ 4.019699e-10 -2.10353e-12 -1.3942012e-10 ] [ 1.8455133e-10 -1.5823794e-10 3.4782497e-10 ] [ 3.974319e-10 3.4739226e-10 2.8853827e-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" -1.7763568e-15 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.846037335159101e-34 } }