{ "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" [ [ 1.235296 0.1194615 1.060663 ] [ 0.5951279 1.958954 0.23753 ] [ 0.7849876 2.237774 2.150251 ] [ 2.634784 1.158802 0.6457174 ] [ 2.006718 1.111823 2.877883 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.235296e-10 1.194615e-11 1.060663e-10 ] [ 5.951279e-11 1.958954e-10 2.3753e-11 ] [ 7.849876000000001e-11 2.237774e-10 2.150251e-10 ] [ 2.634784e-10 1.158802e-10 6.457174e-11 ] [ 2.006718e-10 1.111823e-10 2.877883e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.9721865 -24.5224945 -2.6325002 ] [ -10.8318542 8.9030882 -16.2857659 ] [ -12.9283588 17.9952734 11.57237 ] [ 22.4531199 2.9638152 -10.6500226 ] [ 10.2792796 -5.3396822 17.9959187 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.437502744775738e-08 -3.928936737159659e-08 -4.217730274691324e-09 ] [ -1.735454355915429e-08 1.426431976696035e-08 -2.609267337680187e-08 ] [ -2.071351421467394e-08 2.883160632638412e-08 1.85409806612473e-08 ] [ 3.597386376779924e-08 4.748555421811676e-09 -1.706321722071163e-08 ] [ 1.646922145378638e-08 -8.55511398334191e-09 2.883264021095753e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 4.2359911 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.786805906336875e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.0624566 -0.3602453 1.0255383 ] [ 0.5766957 1.9565345 0.1354261 ] [ 0.5206847 2.7069501 2.4004342 ] [ 2.9839004 1.2875074 0.5271255 ] [ 2.1131761 0.9960679 2.8835203 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0624566e-10 -3.602453e-11 1.0255383e-10 ] [ 5.766957e-11 1.9565345e-10 1.354261e-11 ] [ 5.206847e-11 2.7069501e-10 2.4004342e-10 ] [ 2.9839004e-10 1.2875074e-10 5.271255e-11 ] [ 2.1131761e-10 9.960679e-11 2.8835203e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.46e-05 5.52e-05 -1.2e-06 ] [ 1.7e-06 -2.62e-05 1.66e-05 ] [ 5.3e-06 -9.5e-06 -1.01e-05 ] [ -1.61e-05 -1.29e-05 1.36e-05 ] [ -5.5e-06 -6.7e-06 -1.89e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.339177866368e-14 8.844014946816001e-14 -1.92261194496e-15 ] [ 2.72370025536e-15 -4.197702746496e-14 2.659613190528e-14 ] [ 8.491536090240001e-15 -1.52206778976e-14 -1.618198387008e-14 ] [ -2.579504359488e-14 -2.066807840832e-14 2.178960204288e-14 ] [ -8.8119714144e-15 -1.073458335936e-14 -3.028113813312e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.878088 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.903079489340503e-18 } }