{ "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" [ [ 0.2245113 0.4062398 2.51204 ] [ 0.3734712 1.938106 1.147246 ] [ 0.9603572 2.15083 2.976354 ] [ 2.053947 0.3264748 1.110732 ] [ 2.246066 2.745531 0.3277405 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.245113e-11 4.062398e-11 2.51204e-10 ] [ 3.734712e-11 1.938106e-10 1.147246e-10 ] [ 9.603572000000001e-11 2.15083e-10 2.976354000000001e-10 ] [ 2.053947e-10 3.264748e-11 1.110732e-10 ] [ 2.246066e-10 2.745531e-10 3.277405e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -12.8358706 -25.273068 12.7571546 ] [ -19.2975964 17.7272794 -23.159003 ] [ -0.0625421 23.954006 36.6079856 ] [ 22.1536806 -25.8037702 -14.6663692 ] [ 10.0423284 9.3955527 -11.539768 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.056533178293407e-08 -4.049191868548861e-08 2.043921484805117e-08 ] [ -3.091815778971425e-08 2.840223260506945e-08 -3.710481316763706e-08 ] [ -1.002034904357357e-10 3.837854838770292e-08 5.865245866290306e-08 ] [ 3.549410912199052e-08 -4.134219734293574e-08 -2.34981138442612e-08 ] [ 1.608958378087587e-08 1.505333487543432e-08 -1.848874649905598e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 21.270029 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.407834318753801e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.024095 0.0154391 2.9328932 ] [ 0.5407334 3.3640758 1.1903969 ] [ -0.0882105 2.0839144 3.0606236 ] [ 2.3402564 0.0171015 0.9835753 ] [ 2.0414785 2.0866509 -0.0933765 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.024095e-10 1.54391e-12 2.9328932e-10 ] [ 5.407334e-11 3.364075800000001e-10 1.1903969e-10 ] [ -8.82105e-12 2.0839144e-10 3.0606236e-10 ] [ 2.3402564e-10 1.71015e-12 9.835753e-11 ] [ 2.0414785e-10 2.0866509e-10 -9.33765e-12 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.45e-05 -8e-07 2.2e-06 ] [ -1.98e-05 -7.6e-06 5.1e-06 ] [ 1.85e-05 8.3e-06 -2.7e-06 ] [ 4.6e-06 2e-06 -6.9e-06 ] [ 1.13e-05 -1.9e-06 2.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.32315610016e-14 -1.28174129664e-15 3.52478856576e-15 ] [ -3.172309709184e-14 -1.217654231808e-14 8.17110076608e-15 ] [ 2.96402674848e-14 1.329806595264e-14 -4.32587687616e-15 ] [ 7.370012455680001e-15 3.2043532416e-15 -1.105501868352e-14 ] [ 1.810459581504e-14 -3.04413557952e-15 3.52478856576e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.566682 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.853186748062819e-18 } }