{ "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" [ [ 0.2517942 1.00813 0.5908488 ] [ 0.7479483 2.057521 2.479291 ] [ 2.193445 0.0782553 1.774549 ] [ 2.171144 2.200702 0.4838172 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.517942e-11 1.00813e-10 5.908487999999999e-11 ] [ 7.479483e-11 2.057521e-10 2.479291e-10 ] [ 2.193445e-10 7.82553e-12 1.774549e-10 ] [ 2.171144e-10 2.200702e-10 4.838172e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.058404 -0.9580549 -2.090441 ] [ -1.6354581 2.0293588 3.2211994 ] [ 2.3586739 -3.376251 1.1508564 ] [ 2.3351883 2.3049472 -2.2816148 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.900103385761203e-09 -1.534973162222882e-09 -3.349255697361774e-09 ] [ -2.620292732117988e-09 3.251391224574743e-09 5.160930369614988e-09 ] [ 3.779012178671157e-09 -5.409350418152621e-09 1.843875217978053e-09 ] [ 3.741384099425696e-09 3.692932516018422e-09 -3.655549890231268e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.1868881 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.912487469325734e-19 } "relaxed-configuration-positions" { "source-value" [ [ -0.0213572 1.861647 0.4434266 ] [ 0.3752495 1.2073749 2.7366747 ] [ 2.7035225 0.810657 2.2208255 ] [ 2.3069167 1.4649294 -0.0724209 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -2.13572e-12 1.861647e-10 4.434266e-11 ] [ 3.752495e-11 1.2073749e-10 2.7366747e-10 ] [ 2.7035225e-10 8.10657e-11 2.2208255e-10 ] [ 2.3069167e-10 1.4649294e-10 -7.24209e-12 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.7e-06 -5e-07 1.02e-05 ] [ -1.72e-05 4.3e-06 -3e-06 ] [ 1.61e-05 -5e-06 6.6e-06 ] [ 8.8e-06 1.1e-06 -1.38e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.233675998016e-14 -8.010883104e-16 1.634220153216e-14 ] [ -2.755743787776e-14 6.889359469440001e-15 -4.8065298624e-15 ] [ 2.579504359488e-14 -8.010883104e-15 1.057436569728e-14 ] [ 1.409915426304e-14 1.76239428288e-15 -2.211003736704e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.363135 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.660357261519421e-18 } }