{ "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" [ [ 0.438828 2.90963 1.106787 ] [ 1.47463 4.835343 1.863436 ] [ 2.314132 3.251036 2.795551 ] [ 3.696872 4.248886 0.9164855 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.38828e-11 2.90963e-10 1.106787e-10 ] [ 1.47463e-10 4.835343e-10 1.863436e-10 ] [ 2.314132e-10 3.251036e-10 2.795551e-10 ] [ 3.696872e-10 4.248886e-10 9.164855e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.5013533 0.2585174 0.675643 ] [ -0.5078254 1.9846738 -1.9623752 ] [ 1.2920861 -2.1653531 0.0847307 ] [ -1.285614 -0.0778381 1.2020014 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.032565360209287e-10 4.141905343500019e-10 1.082499418607175e-09 ] [ -8.136259833284083e-10 3.179797962274295e-09 -3.144071666677724e-09 ] [ 2.070150141480651e-09 -3.469278112596804e-09 1.357535466040186e-10 ] [ -2.059780694173171e-09 -1.247103840274925e-10 1.925818541248869e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.4832984 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.519391898455005e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.4625846 3.1514956 1.7636471 ] [ 1.3965678 5.0645025 1.017022 ] [ 2.5656654 2.5579344 2.324086 ] [ 3.4996442 4.4709625 1.5775044 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.625846e-11 3.1514956e-10 1.7636471e-10 ] [ 1.3965678e-10 5.0645025e-10 1.017022e-10 ] [ 2.5656654e-10 2.5579344e-10 2.324086e-10 ] [ 3.4996442e-10 4.4709625e-10 1.5775044e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.62e-05 6.8e-06 -1.65e-05 ] [ -1.46e-05 -4.2e-06 9.7e-06 ] [ 3.23e-05 2.56e-05 2.5e-06 ] [ 8.5e-06 -2.82e-05 4.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.197702746496e-14 1.089480102144e-14 -2.64359142432e-14 ] [ -2.339177866368e-14 -6.72914180736e-15 1.554111322176e-14 ] [ 5.175030485184e-14 4.101572149248001e-14 4.005441552e-15 ] [ 1.36185012768e-14 -4.518138070656001e-14 6.889359469440001e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.837324 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.736330714483474e-18 } }