{ "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" [ [ 0.2245113 0.4062398 2.51204 ] [ 0.3734712 1.938106 1.147246 ] [ 0.9603572 2.15083 2.976354 ] [ 2.053947 0.3264748 1.110732 ] [ 2.246066 2.745531 0.3277405 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.245113e-11 4.062398e-11 2.51204e-10 ] [ 3.734712e-11 1.938106e-10 1.147246e-10 ] [ 9.603572000000001e-11 2.15083e-10 2.976354000000001e-10 ] [ 2.053947e-10 3.264748e-11 1.110732e-10 ] [ 2.246066e-10 2.745531e-10 3.277405e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.3304456 -18.4738075 4.7884562 ] [ -9.658677 6.3675152 -18.2451967 ] [ 8.3790924 13.70271 17.8412528 ] [ 4.7412418 -3.5914058 -2.2435213 ] [ 3.8687884 1.9949881 -2.140991 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.174466856036623e-08 -2.959830247365969e-08 7.671952573364808e-09 ] [ -1.547490647725868e-08 1.020188398602864e-08 -2.923202759463731e-08 ] [ 1.342478594680296e-08 2.195416160360237e-08 2.858483812194254e-08 ] [ 7.59630676551971e-09 -5.75406640856552e-09 -3.594517375126823e-09 ] [ 6.198482325302239e-09 3.196323292594212e-09 -3.430245725543213e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -0.19982838 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.201603586083383e-20 } "relaxed-configuration-positions" { "source-value" [ [ 1.0387096 0.0473077 3.0097106 ] [ 0.2141167 2.4533522 0.7022849 ] [ 0.3883653 2.3480411 3.1096755 ] [ 1.5061594 0.2575569 0.6599333 ] [ 2.7110018 2.4609237 0.5925081 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0387096e-10 4.73077e-12 3.0097106e-10 ] [ 2.141167e-11 2.4533522e-10 7.022849000000001e-11 ] [ 3.883653000000001e-11 2.3480411e-10 3.1096755e-10 ] [ 1.5061594e-10 2.575569e-11 6.599332999999999e-11 ] [ 2.7110018e-10 2.4609237e-10 5.925081e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7e-07 -5.4e-06 -5.1e-06 ] [ 4.5e-06 -2.5e-06 8.7e-06 ] [ -0.0 6.8e-06 -8.9e-06 ] [ -1.2e-06 -1.2e-06 4.4e-06 ] [ -3.9e-06 2.4e-06 8e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.12152363456e-15 -8.65175375232e-15 -8.17110076608e-15 ] [ 7.2097947936e-15 -4.005441552e-15 1.393893660096e-14 ] [ 0.0 1.089480102144e-14 -1.425937192512e-14 ] [ -1.92261194496e-15 -1.92261194496e-15 7.04957713152e-15 ] [ -6.24848882112e-15 3.84522388992e-15 1.28174129664e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.984283 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.759876141885089e-18 } }