{ "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" [ [ 2.561149 2.354583 1.277193 ] [ 2.183709 4.435975 3.101892 ] [ 4.282438 5.412611 2.58259 ] [ 3.622423 4.256941 0.4406492 ] [ 4.442586 3.119258 2.322412 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.561149e-10 2.354583e-10 1.277193e-10 ] [ 2.183709e-10 4.435975e-10 3.101892e-10 ] [ 4.282438e-10 5.412611e-10 2.58259e-10 ] [ 3.622423e-10 4.256941000000001e-10 4.406492e-11 ] [ 4.442586e-10 3.119258e-10 2.322412e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.733698 -4.610814 -0.6499174 ] [ -5.0595217 2.0813601 4.2457784 ] [ 0.6447827 1.6090039 0.9140086 ] [ 1.4911507 4.3683845 -8.3885894 ] [ 7.6572864 -3.4479345 3.8787198 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.584220328012532e-09 -7.387338454520076e-09 -1.041282472310032e-09 ] [ -8.106247446955957e-09 3.334706519159903e-09 6.802486945621904e-09 ] [ 1.033055775947432e-09 2.577908452594872e-09 1.464403222195052e-09 ] [ 2.389086809312743e-09 6.998923574227773e-09 -1.344000192890008e-08 ] [ 1.226832534992598e-08 -5.524200091462472e-09 6.214394233393152e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.3783818 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.021929428269086e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6232719 2.6391788 1.4659786 ] [ 1.8435624 4.4434609 3.1532707 ] [ 4.2136419 5.1925639 2.4239426 ] [ 3.4981934 4.5930975 0.0074742 ] [ 4.9136354 2.7110669 2.67407 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6232719e-10 2.6391788e-10 1.4659786e-10 ] [ 1.8435624e-10 4.4434609e-10 3.1532707e-10 ] [ 4.2136419e-10 5.1925639e-10 2.4239426e-10 ] [ 3.4981934e-10 4.5930975e-10 7.474200000000001e-13 ] [ 4.913635400000001e-10 2.7110669e-10 2.67407e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.55e-05 4.73e-05 7.6e-06 ] [ -2.06e-05 1.39e-05 2.84e-05 ] [ -4.31e-05 -4.28e-05 -5.51e-05 ] [ 4e-06 1.28e-05 7.6e-06 ] [ 4.2e-06 -3.12e-05 1.16e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.892080318699998e-14 7.578295478819998e-14 1.21765424184e-14 ] [ -3.300483866039999e-14 2.22702552126e-14 4.550181640559999e-14 ] [ -6.90538129254e-14 -6.857315993519999e-14 -8.827993253339999e-14 ] [ 6.408706535999999e-15 2.05078609152e-14 1.21765424184e-14 ] [ 6.729141862799999e-15 -4.998791098079999e-14 1.85852489544e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.025254 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.926658097671503e-18 } }