{ "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" [ [ 0.1724043 0.1217148 2.355607 ] [ 0.0803944 1.628444 0.6781111 ] [ 0.0194903 2.198586 2.964695 ] [ 2.614645 0.684385 2.185781 ] [ 2.191382 2.601245 1.67848 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.724043e-11 1.217148e-11 2.355607e-10 ] [ 8.03944e-12 1.628444e-10 6.781111e-11 ] [ 1.94903e-12 2.198586e-10 2.964695e-10 ] [ 2.614645e-10 6.84385e-11 2.185781e-10 ] [ 2.191382e-10 2.601245e-10 1.67848e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.1066832 -3.6654691 0.1956442 ] [ 0.7011514 1.548906 -1.7141529 ] [ 0.7175403 3.6758597 1.0184986 ] [ 0.7955 -9.1353634 2.4572556 ] [ -4.3208748 7.5760668 -1.9572454 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.37527857047213e-09 -5.872728896284818e-09 3.134565632351194e-10 ] [ 1.123368380721189e-09 2.481620981016845e-09 -2.74637570085652e-09 ] [ 1.149626293141818e-09 5.889376472680903e-09 1.631814645237531e-09 ] [ 1.2745315018464e-09 -1.4636465661992e-08 3.936957473649877e-09 ] [ -6.922804585963877e-09 1.213819710457907e-08 -3.135852821048344e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.465127 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.997133505470284e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.3412604 0.0616381 2.3348625 ] [ 0.0510101 1.7232138 0.6167096 ] [ 0.0153113 2.3585304 2.9791981 ] [ 2.6550482 0.455742 2.2638343 ] [ 2.015686 2.6352505 1.6680695 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.412604e-11 6.16381e-12 2.3348625e-10 ] [ 5.10101e-12 1.7232138e-10 6.167096e-11 ] [ 1.53113e-12 2.3585304e-10 2.9791981e-10 ] [ 2.6550482e-10 4.55742e-11 2.2638343e-10 ] [ 2.015686e-10 2.6352505e-10 1.6680695e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.2e-06 -2.9e-06 -4.6e-06 ] [ -7.2e-06 -7.8e-06 -6.1e-06 ] [ 1.14e-05 3e-07 2.2e-06 ] [ 5e-07 2e-06 4.1e-06 ] [ 2.5e-06 8.4e-06 4.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.153567166976e-14 -4.646312200320001e-15 -7.370012455680001e-15 ] [ -1.153567166976e-14 -1.249697764224e-14 -9.77327738688e-15 ] [ 1.826481347712e-14 4.8065298624e-16 3.52478856576e-15 ] [ 8.010883104e-16 3.2043532416e-15 6.568924145279999e-15 ] [ 4.005441552e-15 1.345828361472e-14 7.04957713152e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.214602 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.277430299837692e-18 } }