{ "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" [ [ 1.466656 0.07552 0.8362243 ] [ 0.0979932 0.4288587 1.191786 ] [ 0.4994915 2.11153 0.6404272 ] [ 2.455877 2.004038 2.378996 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.466656e-10 7.552e-12 8.362243000000001e-11 ] [ 9.799320000000001e-12 4.288587e-11 1.191786e-10 ] [ 4.994915e-11 2.11153e-10 6.404272e-11 ] [ 2.455877e-10 2.004038e-10 2.378996e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 54.7656341 -25.8375121 -11.2995765 ] [ -51.6478295 -0.976512 16.9987857 ] [ -3.1178046 26.8140241 -5.6992092 ] [ 0.0 0.0 0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.774421857830725e-08 -4.139625782625712e-08 -1.810391729324109e-08 ] [ -8.274894493996455e-08 -1.56454469633065e-09 2.723505703052936e-08 ] [ -4.995273638342696e-09 4.296080252258776e-08 -9.131139737288272e-09 ] [ 0.0 0.0 0.0 ] ] } "unrelaxed-potential-energy" { "source-value" 13.031333 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.087849707045953e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.8208949 -0.9925649 0.9886147 ] [ 0.5314303 0.7905348 0.9606654 ] [ -0.2881846 2.8179388 0.7191574 ] [ 2.455877 2.004038 2.378996 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8208949e-10 -9.925649e-11 9.886147e-11 ] [ 5.314303e-11 7.905348000000001e-11 9.606654e-11 ] [ -2.881846e-11 2.8179388e-10 7.191573999999999e-11 ] [ 2.455877e-10 2.004038e-10 2.378996e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0281203 0.0238475 0.003154 ] [ 0.0576513 -0.073237 -0.0003733 ] [ -0.029531 0.0493895 -0.0027807 ] [ 0.0 0.0 0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.505368722988224e-11 3.8207906964528e-11 5.0532650620032e-12 ] [ 9.236756501872704e-11 -1.173386091775296e-10 -5.980925325446401e-13 ] [ -4.73138777888448e-11 7.913070221300161e-11 -4.45517252945856e-12 ] [ 0.0 0.0 0.0 ] ] } "relaxed-potential-energy" { "source-value" -5.6509354 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.053796583531097e-19 } }