{ "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" [ [ 0.8096372 4.258191 1.47714 ] [ 2.994591 3.495273 0.7283127 ] [ 2.242727 3.316143 2.81578 ] [ 4.437987 1.666008 1.836401 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.096372e-11 4.258191e-10 1.47714e-10 ] [ 2.994591e-10 3.495273e-10 7.283127e-11 ] [ 2.242727e-10 3.316143e-10 2.81578e-10 ] [ 4.437987e-10 1.666008e-10 1.836401e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.8825472 1.3372744 -0.3825098 ] [ 1.4862939 -0.7086702 0.2765557 ] [ 1.3962533 -0.6286042 0.1059541 ] [ 0.0 0.0 0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.618349732192501e-09 2.142549779274348e-09 -6.128482587868838e-10 ] [ 2.381305338217653e-09 -1.13541482629766e-09 4.430910768889786e-10 ] [ 2.237044393974849e-09 -1.007134952976687e-09 1.697571818979053e-10 ] [ 0.0 0.0 0.0 ] ] } "unrelaxed-potential-energy" { "source-value" -4.1563724 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.659242686618387e-19 } "relaxed-configuration-positions" { "source-value" [ [ -0.23497 4.7522685 2.0701277 ] [ 3.6415773 2.7552765 1.5846578 ] [ 1.7842286 3.908768 1.8394917 ] [ 5.2941063 1.319302 1.3633564 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -2.3497e-11 4.7522685e-10 2.0701277e-10 ] [ 3.6415773e-10 2.7552765e-10 1.5846578e-10 ] [ 1.7842286e-10 3.908768e-10 1.8394917e-10 ] [ 5.2941063e-10 1.319302e-10 1.3633564e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0027917 0.0035577 0.0005892 ] [ -0.0079473 0.0031206 0.0014428 ] [ 0.0063181 -0.005753 -0.0014013 ] [ 0.0044209 -0.0009253 -0.0006307 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.47279647228736e-12 5.70006376382016e-12 9.4400246497536e-13 ] [ -1.273297825848384e-11 4.99975236286848e-12 2.31162042849024e-12 ] [ 1.012271210787648e-11 -9.2173220994624e-12 -2.24513009872704e-12 ] [ 7.083062622894721e-12 -1.48249402722624e-12 -1.01049279473856e-12 ] ] } "relaxed-potential-energy" { "source-value" -8.4173814 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.348613168743677e-18 } }