{ "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" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.750115 2.05781 3.008489 ] [ 2.459373 1.512643 5.182306 ] [ 3.045421 4.403069 3.012822 ] [ 1.351279 3.64529 4.777489 ] [ 4.685264 1.369475 1.888704 ] [ 3.677702 3.202643 0.9471066 ] [ 3.576002 3.111527 4.892003 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.750115e-10 2.05781e-10 3.008489e-10 ] [ 2.459373e-10 1.512643e-10 5.182306e-10 ] [ 3.045421e-10 4.403069e-10 3.012822e-10 ] [ 1.351279e-10 3.64529e-10 4.777489e-10 ] [ 4.685264e-10 1.369475e-10 1.888704e-10 ] [ 3.677702e-10 3.202643e-10 9.471066000000001e-11 ] [ 3.576002e-10 3.111527e-10 4.892003e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.8612686 -0.1998872 -3.2728429 ] [ -5.4818063 -6.679813 2.8851967 ] [ -0.6003324 0.1428872 -0.4062987 ] [ 0.6235746 -0.3701285 -0.7603428 ] [ 0.6682513 -0.3590203 0.0473178 ] [ -0.6334432 0.3403853 1.3622689 ] [ 6.2850245 7.1255765 0.144701 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.379904415149147e-09 -3.202545986371737e-10 -5.243672377931272e-09 ] [ -8.78282189361415e-09 -1.070224021991591e-08 4.622594699149311e-09 ] [ -9.618385359887539e-10 2.289305312515738e-10 -6.50962278201433e-10 ] [ 9.990766454447118e-10 -5.930112293917729e-10 -1.21820345795361e-09 ] [ 1.070656609679207e-09 -5.752139310526023e-10 7.581147290769025e-11 ] [ -1.014887885644738e-09 5.453573697239943e-10 2.182595382822933e-09 ] [ 1.006971931505521e-08 1.141643207802189e-08 2.318365592063808e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -24.915787 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.991949142023257e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9456047 2.1977028 2.5806545 ] [ 2.7744306 1.3183249 4.6842507 ] [ 2.8894901 4.4408546 2.9462531 ] [ 1.7497739 3.3941624 4.6819777 ] [ 4.2999781 1.5834191 2.9494151 ] [ 3.7423319 3.0831314 1.2665848 ] [ 4.1435468 3.2848617 4.5997838 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9456047e-10 2.1977028e-10 2.5806545e-10 ] [ 2.7744306e-10 1.3183249e-10 4.6842507e-10 ] [ 2.8894901e-10 4.4408546e-10 2.9462531e-10 ] [ 1.7497739e-10 3.3941624e-10 4.6819777e-10 ] [ 4.2999781e-10 1.5834191e-10 2.9494151e-10 ] [ 3.7423319e-10 3.0831314e-10 1.2665848e-10 ] [ 4.1435468e-10 3.2848617e-10 4.5997838e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.02e-05 -4.24e-05 3.19e-05 ] [ 1.48e-05 7.8e-06 3.58e-05 ] [ 2.94e-05 -1.81e-05 7.18e-05 ] [ 2.79e-05 8.5e-06 -7.29e-05 ] [ -2.77e-05 -4e-06 -3.04e-05 ] [ 1.94e-05 2.81e-05 -4.07e-05 ] [ -4.36e-05 2.02e-05 4.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.236396774016e-14 -6.793228872192001e-14 5.110943420352001e-14 ] [ 2.371221398784e-14 1.249697764224e-14 5.735792302464001e-14 ] [ 4.710399265152e-14 -2.899939683648e-14 1.1503628137344e-13 ] [ 4.470072772032e-14 1.36185012768e-14 -1.1679867565632e-13 ] [ -4.438029239616e-14 -6.4087064832e-15 -4.870616927232e-14 ] [ 3.108222644352e-14 4.502116304448e-14 -6.520858846656e-14 ] [ -6.985490066688e-14 3.236396774016e-14 7.04957713152e-15 ] ] } "relaxed-potential-energy" { "source-value" -30.380528 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.867497168915979e-18 } }