{ "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" [ [ 1.26846 0.3454837 2.901552 ] [ 0.267977 2.35609 2.023372 ] [ 2.685563 0.3914351 1.602855 ] [ 2.683655 1.904541 0.876934 ] [ 1.547568 2.030572 0.3165864 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.26846e-10 3.454837e-11 2.901552e-10 ] [ 2.67977e-11 2.35609e-10 2.023372e-10 ] [ 2.685563e-10 3.914351e-11 1.602855e-10 ] [ 2.683655e-10 1.904541e-10 8.769340000000001e-11 ] [ 1.547568e-10 2.030572e-10 3.165864e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.0831235 -8.679652 14.0087832 ] [ -13.1368116 8.6107335 6.2300655 ] [ 12.7127737 -18.4161508 2.0887275 ] [ 28.8757496 11.2098353 1.1496345 ] [ -21.3685882 7.275234 -23.4772107 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.134841487393907e-08 -1.390633551107996e-08 2.244454492889581e-08 ] [ -2.104749241737424e-08 1.379591590163936e-08 9.981665290152662e-09 ] [ 2.036810880766111e-08 -2.950592625688722e-08 3.346510367722032e-09 ] [ 4.626405091719496e-08 1.796013604067856e-08 1.841917518365097e-09 ] [ -3.423625243354276e-08 1.165620982564927e-08 -3.761463810513561e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 71.616725 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.147426424532629e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.3608062 -0.8490089 4.8540431 ] [ -1.117933 4.0430847 2.8216184 ] [ 4.1136407 -1.762729 0.9385165 ] [ 4.6461576 3.7165945 1.100027 ] [ 0.4505514 1.8801805 -1.9929055 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.608062e-11 -8.490089e-11 4.854043100000001e-10 ] [ -1.117933e-10 4.0430847e-10 2.8216184e-10 ] [ 4.113640700000001e-10 -1.762729e-10 9.385165e-11 ] [ 4.646157600000001e-10 3.7165945e-10 1.100027e-10 ] [ 4.505514e-11 1.8801805e-10 -1.9929055e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0 -0.0 0.0 ] [ -0.0 0.0 -0.0 ] [ 0.0 -0.0 -0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] } "relaxed-potential-energy" { "source-value" 0.0 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 0.0 } }