{ "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" [ [ 1.63984 2.632724 3.733643 ] [ 2.059322 3.100925 1.548727 ] [ 0.4497259 4.960249 3.35449 ] [ 2.730005 4.489518 3.533282 ] [ 4.056337 2.434117 2.913545 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.63984e-10 2.632724e-10 3.733643e-10 ] [ 2.059322e-10 3.100925e-10 1.548727e-10 ] [ 4.497259e-11 4.960249e-10 3.35449e-10 ] [ 2.730005e-10 4.489518e-10 3.533282e-10 ] [ 4.056337e-10 2.434117e-10 2.913545e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.00875 -8.8858715 6.3105083 ] [ -2.9474929 -2.7076162 -11.8663872 ] [ -4.0353178 3.577101 0.3311811 ] [ 5.7631008 11.8253052 5.4182543 ] [ 8.2284598 -3.8089185 -0.1935566 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.1229255391032e-08 -1.423673557273303e-08 1.011054886362435e-08 ] [ -4.722404214353992e-09 -4.338079373739337e-09 -1.901204814520037e-08 ] [ -6.465291836658089e-09 5.7311475924403e-09 5.306106156708269e-10 ] [ 9.233505365073777e-09 1.894622752526467e-08 8.681000365009071e-09 ] [ 1.318344591675264e-08 -6.102560171232605e-09 -3.101118593215373e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -6.1072135 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.784834687934143e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.2207938 2.6473042 2.8866925 ] [ 2.3288515 1.7448182 1.8055607 ] [ 0.830062 4.7605795 4.1476822 ] [ 3.3146148 5.1643222 3.8456532 ] [ 4.2409077 3.3005089 2.3980983 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.207938e-11 2.6473042e-10 2.8866925e-10 ] [ 2.3288515e-10 1.7448182e-10 1.8055607e-10 ] [ 8.30062e-11 4.760579500000001e-10 4.1476822e-10 ] [ 3.3146148e-10 5.1643222e-10 3.8456532e-10 ] [ 4.2409077e-10 3.3005089e-10 2.3980983e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.1e-06 1.2e-06 1.5e-06 ] [ -1.9e-06 1.8e-06 3e-07 ] [ -1.4e-06 -2.7e-06 -2.3e-06 ] [ 1.3e-06 -6e-07 -6e-07 ] [ -1.2e-06 2e-07 1.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.96674752448e-15 1.92261194496e-15 2.4032649312e-15 ] [ -3.04413557952e-15 2.88391791744e-15 4.8065298624e-16 ] [ -2.24304726912e-15 -4.32587687616e-15 -3.68500622784e-15 ] [ 2.08282960704e-15 -9.6130597248e-16 -9.6130597248e-16 ] [ -1.92261194496e-15 3.2043532416e-16 1.92261194496e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.716098 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.197561154420164e-18 } }