{ "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" [ [ 2.10043 2.130682 2.453785 ] [ 1.948071 1.785129 4.606922 ] [ 2.343053 4.336787 1.957735 ] [ 4.413531 1.079857 2.965455 ] [ 3.524463 3.435576 3.796327 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.10043e-10 2.130682e-10 2.453785e-10 ] [ 1.948071e-10 1.785129e-10 4.606922e-10 ] [ 2.343053e-10 4.336787e-10 1.957735e-10 ] [ 4.413531e-10 1.079857e-10 2.965455e-10 ] [ 3.524463e-10 3.435576e-10 3.796327e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.887866 -4.0587911 -4.7646551 ] [ -1.8635711 -1.368297 3.4241973 ] [ -0.4824435 2.3275846 -1.4792618 ] [ 0.5974094 -0.2081066 -0.4247568 ] [ 4.6364712 3.3076101 3.2444764 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.626871389203213e-09 -6.502900209131114e-09 -7.633819007395485e-09 ] [ -2.985770047618539e-09 -2.192253463710778e-09 5.486168859066484e-09 ] [ -7.729596965569249e-10 3.72920162905412e-09 -2.370038672002525e-09 ] [ 9.571553737261555e-10 -3.334235291541773e-10 -6.805354144858214e-10 ] [ 7.428445759652521e-09 5.299375572941951e-09 5.198224234817349e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.3229895 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.528369329663882e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.9431264 1.6883975 2.214 ] [ 1.8205207 2.1096729 4.5877808 ] [ 2.478791 4.0417638 2.1684661 ] [ 4.2984217 1.5093781 2.7118866 ] [ 3.7886883 3.4188187 4.0980905 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9431264e-10 1.6883975e-10 2.214e-10 ] [ 1.8205207e-10 2.1096729e-10 4.5877808e-10 ] [ 2.478791000000001e-10 4.0417638e-10 2.1684661e-10 ] [ 4.2984217e-10 1.5093781e-10 2.7118866e-10 ] [ 3.7886883e-10 3.4188187e-10 4.0980905e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.55e-05 8.1e-06 7.9e-06 ] [ -2.3e-06 1.41e-05 -8.3e-06 ] [ -4.8e-06 -1.26e-05 1.52e-05 ] [ -1e-06 2.6e-06 -3e-06 ] [ -7.5e-06 -1.22e-05 -1.18e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.48337376224e-14 1.297763062848e-14 1.265719530432e-14 ] [ -3.68500622784e-15 2.259069035328e-14 -1.329806595264e-14 ] [ -7.69044777984e-15 -2.018742542208e-14 2.435308463616e-14 ] [ -1.6021766208e-15 4.16565921408e-15 -4.8065298624e-15 ] [ -1.2016324656e-14 -1.954655477376e-14 -1.890568412544e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.3509582 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.337970998931805e-18 } }