{ "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" [ [ 0.0492615 -2.3946769 -3.4006599 ] [ -0.3849383 -0.2278595 3.0963128 ] [ 0.1052726 1.4605886 -0.4001721 ] [ -1.1725035 1.5569789 -0.0359188 ] [ 1.4029077 -0.3950313 0.740438 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.892562425579099e-11 -3.836695375159554e-09 -5.448457831960775e-09 ] [ -6.167391497916821e-10 -3.650711667349229e-10 4.960840019715115e-09 ] [ 1.686652999204284e-10 2.340120926806772e-09 -6.411463881987113e-10 ] [ -1.878557710983219e-09 2.494555213211023e-09 -5.75482620813192e-11 ] [ 2.247705936598682e-09 -6.329099185586441e-10 1.186312462525692e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.714537 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.037093409352846e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1515437 1.8809743 2.4180298 ] [ 1.6743306 2.0417596 4.7759355 ] [ 2.426693 4.24607 2.0386639 ] [ 4.4967072 1.372988 2.6535313 ] [ 3.5802735 3.2262391 3.8940634 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1515437e-10 1.8809743e-10 2.4180298e-10 ] [ 1.6743306e-10 2.0417596e-10 4.7759355e-10 ] [ 2.426693e-10 4.24607e-10 2.0386639e-10 ] [ 4.496707200000001e-10 1.372988e-10 2.6535313e-10 ] [ 3.5802735e-10 3.2262391e-10 3.8940634e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -9.5e-06 -1.01e-05 -1.14e-05 ] [ -1.9e-06 2.1e-06 5.4e-06 ] [ -2.1e-06 8.8e-06 3.4e-06 ] [ 8.7e-06 -3.6e-06 4e-06 ] [ 4.9e-06 2.8e-06 -1.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.5220678023e-14 -1.61819840034e-14 -1.82648136276e-14 ] [ -3.0441356046e-15 3.364570931399999e-15 8.6517538236e-15 ] [ -3.364570931399999e-15 1.40991543792e-14 5.4474005556e-15 ] [ 1.39389367158e-14 -5.767835882399999e-15 6.408706535999999e-15 ] [ 7.850665506599998e-15 4.486094575199999e-15 -2.2430472876e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.621881 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.182465944932855e-18 } }