{ "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" [ [ 1.097689 0.3905239 0.41263 ] [ 0.032965 0.0756626 2.808384 ] [ 2.827906 0.6568563 1.349893 ] [ 2.515385 2.187975 0.7174512 ] [ 1.727021 2.867394 2.060494 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.097689e-10 3.905239e-11 4.1263e-11 ] [ 3.2965e-12 7.56626e-12 2.808384e-10 ] [ 2.827906e-10 6.568562999999999e-11 1.349893e-10 ] [ 2.515385e-10 2.187975e-10 7.174512e-11 ] [ 1.727021e-10 2.867394e-10 2.060494e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.5778707 -4.0563546 -0.5181226 ] [ 3.0788533 1.7850379 -3.5463672 ] [ 4.0651379 -10.1681607 5.8951067 ] [ 3.6408332 6.882194 -11.5529378 ] [ -5.2069537 5.5572834 9.722321 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.936734029385332e-09 -6.498996505794536e-09 -8.3012391642811e-10 ] [ 4.932866776132928e-09 2.859945990621929e-09 -5.681906616611959e-09 ] [ 6.513068903708008e-09 -1.629118935007736e-08 9.44500213186144e-09 ] [ 5.83325783327245e-09 1.102649032661004e-08 -1.850984684471659e-08 ] [ -8.342459483728057e-09 8.903749538639935e-09 1.557687540611288e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -3.192584 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.115083444740148e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.9552597 -0.570276 0.9324559 ] [ -0.0906142 0.9255611 2.438208 ] [ 3.1063043 0.3024413 0.4715532 ] [ 3.059144 2.5939189 1.0604019 ] [ 1.1708722 2.9267666 2.4462333 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.552597e-11 -5.70276e-11 9.324559e-11 ] [ -9.061420000000001e-12 9.255611e-11 2.438208e-10 ] [ 3.1063043e-10 3.024413e-11 4.715532e-11 ] [ 3.059144e-10 2.5939189e-10 1.0604019e-10 ] [ 1.1708722e-10 2.9267666e-10 2.4462333e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.46e-05 -2.4e-06 7.1e-06 ] [ 3.9e-06 -4.33e-05 -2.02e-05 ] [ -2.51e-05 3.74e-05 2.78e-05 ] [ 8.5e-06 -1.13e-05 -9.5e-06 ] [ 2.73e-05 1.96e-05 -5.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.339177866368e-14 -3.84522388992e-15 1.137545400768e-14 ] [ 6.24848882112e-15 -6.937424768064e-14 -3.236396774016e-14 ] [ -4.021463318208e-14 5.992140561792e-14 4.454051005824e-14 ] [ 1.36185012768e-14 -1.810459581504e-14 -1.52206778976e-14 ] [ 4.373942174784e-14 3.140266176767999e-14 -8.33131842816e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.976835 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.239335826977917e-18 } }