{ "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" [ [ 2.101107 2.382088 1.155059 ] [ 1.870329 4.675053 0.5879216 ] [ 2.558831 4.133121 3.113399 ] [ 4.446179 2.802067 2.809564 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.101107e-10 2.382088e-10 1.155059e-10 ] [ 1.870329e-10 4.675053e-10 5.879216e-11 ] [ 2.558831e-10 4.133121e-10 3.113399e-10 ] [ 4.446179e-10 2.802067e-10 2.809564e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.7510312 -4.9298248 0.4971945 ] [ -0.4692964 4.2323732 -1.028749 ] [ -3.8546808 3.7004447 1.5127625 ] [ 3.5729461 -3.0029931 -0.9812079 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.203284630131369e-09 -7.898450039200035e-09 7.965934038903456e-10 ] [ -7.518957203056051e-10 6.781009391540482e-09 -1.648237596471379e-09 ] [ -6.175879458406641e-09 5.928765984903269e-09 2.42371271032296e-09 ] [ 5.724490708798538e-09 -4.811325337243716e-09 -1.572068357524264e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.6322 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.703466226766976e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.418137 2.3471688 1.1459135 ] [ 1.6292972 4.7631402 0.6434617 ] [ 2.5665225 4.3703869 3.0265127 ] [ 4.3624892 2.5116331 2.8500557 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.418137e-10 2.3471688e-10 1.1459135e-10 ] [ 1.6292972e-10 4.7631402e-10 6.434617e-11 ] [ 2.5665225e-10 4.3703869e-10 3.0265127e-10 ] [ 4.3624892e-10 2.5116331e-10 2.8500557e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.91e-05 4.92e-05 4.84e-05 ] [ 1.36e-05 -4.25e-05 -2.58e-05 ] [ 1.02e-05 -1.27e-05 3.97e-05 ] [ -6.29e-05 6e-06 -6.23e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.264510587328001e-14 7.882708974336e-14 7.754534844671999e-14 ] [ 2.178960204288e-14 -6.8092506384e-14 -4.133615681664e-14 ] [ 1.634220153216e-14 -2.034764308416e-14 6.360641184576e-14 ] [ -1.0077690944832e-13 9.6130597248e-15 -9.981560347584e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.069862 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.933805071268233e-18 } }