{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.889016 4.339495 1.275975 ] [ 2.554838 3.101562 2.999193 ] [ 4.055705 3.657127 1.332404 ] [ 4.476672 4.505138 3.486766 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.889016e-10 4.339495e-10 1.275975e-10 ] [ 2.554838e-10 3.101562e-10 2.999193e-10 ] [ 4.055705e-10 3.657127e-10 1.332404e-10 ] [ 4.476672e-10 4.505138e-10 3.486766e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.9985248 1.1727988 -1.8473289 ] [ 0.0138751 -0.916182 2.5954909 ] [ 1.9374575 0.1362776 -1.0580913 ] [ 0.0471921 -0.3928943 0.3099293 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.201989710648996e-09 1.879030818262295e-09 -2.959747174508181e-09 ] [ 2.223036083126208e-11 -1.467885380797786e-09 4.158434839479151e-09 ] [ 3.104149110293616e-09 2.183407846587341e-10 -1.695249143531879e-09 ] [ 7.56100793064557e-11 -6.294860619055814e-10 4.965614785609095e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -10.04706 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.609716463977485e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7359446 4.114048 1.0503701 ] [ 2.5107996 3.3334361 3.1447296 ] [ 4.0785359 3.9161528 1.3134238 ] [ 4.650951 4.2396851 3.5858146 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7359446e-10 4.114048e-10 1.0503701e-10 ] [ 2.5107996e-10 3.3334361e-10 3.1447296e-10 ] [ 4.078535900000001e-10 3.9161528e-10 1.3134238e-10 ] [ 4.650951e-10 4.2396851e-10 3.5858146e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.3e-06 -6.4e-06 3.2e-06 ] [ 2.8e-06 8.2e-06 -1.68e-05 ] [ -1.16e-05 3e-07 8.7e-06 ] [ 7.5e-06 -2e-06 4.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.08282960704e-15 -1.025393037312e-14 5.126965186560001e-15 ] [ 4.48609453824e-15 1.313784829056e-14 -2.691656722944e-14 ] [ -1.858524880128e-14 4.8065298624e-16 1.393893660096e-14 ] [ 1.2016324656e-14 -3.2043532416e-15 7.850665441919999e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.547071 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.689827057411768e-18 } }