{ "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" [ [ 2.194843 2.698336 1.615904 ] [ 2.342296 1.479956 3.870973 ] [ 2.299802 3.774539 3.510423 ] [ 4.310954 2.51113 2.445623 ] [ 3.93016 4.43603 0.8578151 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.194843e-10 2.698336e-10 1.615904e-10 ] [ 2.342296e-10 1.479956e-10 3.870973000000001e-10 ] [ 2.299802e-10 3.774539e-10 3.510423e-10 ] [ 4.310954e-10 2.51113e-10 2.445623e-10 ] [ 3.93016e-10 4.43603e-10 8.578151e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.5736411 0.2779134 -7.1158386 ] [ 0.0176503 -4.4340662 2.9619657 ] [ -1.8804069 6.1492126 4.0242579 ] [ 4.9002027 -0.7917968 -0.4971792 ] [ -0.4638051 -1.2012629 0.6267941 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.123427600749995e-09 4.452663520870387e-10 -1.14008302423062e-08 ] [ 2.827889801010624e-11 -7.104157200719498e-09 4.745592196151506e-09 ] [ -3.012743972771004e-09 9.852124664048783e-09 6.447571923449705e-09 ] [ 7.850990203121037e-09 -1.268598321384253e-09 -7.965688905880473e-10 ] [ -7.430976878278061e-10 -1.924635333814408e-09 1.004234853075377e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.110339 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.100507863656245e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9611191 3.0799976 1.6045539 ] [ 2.5485417 1.3021517 3.3289426 ] [ 2.2243542 3.8270848 4.0236216 ] [ 4.3273866 3.049841 2.8184339 ] [ 4.0166535 3.6409159 0.5251861 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9611191e-10 3.0799976e-10 1.6045539e-10 ] [ 2.5485417e-10 1.3021517e-10 3.3289426e-10 ] [ 2.2243542e-10 3.8270848e-10 4.023621600000001e-10 ] [ 4.3273866e-10 3.049841e-10 2.8184339e-10 ] [ 4.0166535e-10 3.6409159e-10 5.251861e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.3e-06 -0.0 3.71e-05 ] [ 1.43e-05 3.66e-05 -4.3e-06 ] [ 1.93e-05 -3.51e-05 -1.32e-05 ] [ -6.77e-05 5.4e-06 -9.1e-06 ] [ 3.55e-05 -6.9e-06 -1.05e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.08282960704e-15 0.0 5.944075263168e-14 ] [ 2.291112567744e-14 5.863966432128e-14 -6.889359469440001e-15 ] [ 3.092200878144e-14 -5.623639939008e-14 -2.114873139456e-14 ] [ -1.0846735722816e-13 8.65175375232e-15 -1.457980724928e-14 ] [ 5.68772700384e-14 -1.105501868352e-14 -1.68228545184e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.499658 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.483318967799569e-18 } }