{ "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" [ [ 0.1139215 0.7675217 1.173379 ] [ 0.3197986 0.4128002 2.663942 ] [ 1.547269 0.0076724 0.5415715 ] [ 1.777725 2.329132 1.457723 ] [ 2.606996 1.505358 2.342036 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.139215e-11 7.675217e-11 1.173379e-10 ] [ 3.197986e-11 4.128002e-11 2.663942e-10 ] [ 1.547269e-10 7.672400000000001e-13 5.415715e-11 ] [ 1.777725e-10 2.329132e-10 1.457723e-10 ] [ 2.606996e-10 1.505358e-10 2.342036e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -475.1001678 522.8804631 -1504.4725976 ] [ 230.3375406 -382.0238752 1613.2406455 ] [ 255.3873069 -129.1827276 -105.4202492 ] [ -1969.7299626 1945.4383818 -2096.7079062 ] [ 1959.1052828 -1957.1122421 2093.3601075 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.611943813873169e-07 8.377468534518971e-07 -2.410430822508966e-06 ] [ 3.690414224418908e-07 -6.12069721432857e-07 2.584696445944401e-06 ] [ 4.091755723642545e-07 -2.069735459718949e-07 -1.689018586271499e-07 ] [ -3.155855295366978e-06 3.116935892526944e-06 -3.359296387960159e-06 ] [ 3.138832681787932e-06 -3.135639478574089e-06 3.353932623151875e-06 ] ] } "unrelaxed-potential-energy" { "source-value" 590.91861 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 9.467559817376331e-17 } "relaxed-configuration-positions" { "source-value" [ [ -0.2993839 0.9593891 0.749528 ] [ 0.6802607 0.6201334 2.7073384 ] [ 1.7561397 0.1364333 0.8228557 ] [ 1.3830246 2.2569234 1.3769996 ] [ 2.845669 1.0496051 2.5219298 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -2.993839e-11 9.593891e-11 7.49528e-11 ] [ 6.802607e-11 6.201334e-11 2.7073384e-10 ] [ 1.7561397e-10 1.364333e-11 8.228557e-11 ] [ 1.3830246e-10 2.2569234e-10 1.3769996e-10 ] [ 2.845669e-10 1.0496051e-10 2.5219298e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.01e-05 8.4e-06 4.7e-05 ] [ -4.11e-05 9e-06 5.6e-06 ] [ 2.56e-05 2.36e-05 -6.08e-05 ] [ -6.6e-06 -4.03e-05 -4.65e-05 ] [ 3.22e-05 -7e-07 5.47e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.618198387008e-14 1.345828361472e-14 7.530230117759999e-14 ] [ -6.584945911488e-14 1.44195895872e-14 8.972189076479999e-15 ] [ 4.101572149248001e-14 3.781136825088e-14 -9.741233854464e-14 ] [ -1.057436569728e-14 -6.456771781824e-14 -7.45012128672e-14 ] [ 5.159008718975999e-14 -1.12152363456e-15 8.763906115775999e-14 ] ] } "relaxed-potential-energy" { "source-value" -28.867458 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.625076630952593e-18 } }