{ "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" [ [ 2.61188 5.080623 2.93239 ] [ 4.855786 1.762639 3.084137 ] [ 3.780411 3.32193 1.747479 ] [ 4.346291 4.090656 3.759617 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.61188e-10 5.080623e-10 2.93239e-10 ] [ 4.855786000000001e-10 1.762639e-10 3.084137e-10 ] [ 3.780411e-10 3.32193e-10 1.747479e-10 ] [ 4.346291e-10 4.090656e-10 3.759617e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.561702 1.1230285 -1.2716544 ] [ -0.0352036 0.0980651 0.5393677 ] [ -1.0980523 -0.5087382 -3.3080239 ] [ 3.6949579 -0.7123554 4.0403107 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.104299087671067e-09 1.799290022016069e-09 -2.03741496620329e-09 ] [ -5.640238535268239e-11 1.571176118308734e-10 8.641623260743217e-10 ] [ -1.759273737969958e-09 -8.150884568632187e-10 -5.300038597293552e-09 ] [ 5.919975210993708e-09 -1.141319176983724e-09 6.473291397640183e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.2024091 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.474388483652897e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5568142 4.9310908 2.9086267 ] [ 4.7108784 1.8487028 3.1421629 ] [ 3.7727203 3.3779552 1.5868986 ] [ 4.5539551 4.0980993 3.8859347 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5568142e-10 4.9310908e-10 2.9086267e-10 ] [ 4.710878400000001e-10 1.8487028e-10 3.1421629e-10 ] [ 3.7727203e-10 3.3779552e-10 1.5868986e-10 ] [ 4.5539551e-10 4.098099300000001e-10 3.8859347e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.38e-05 -2.35e-05 -3.49e-05 ] [ -1.81e-05 -4.4e-06 9.3e-06 ] [ -7.9e-06 3.58e-05 8.4e-06 ] [ 5.98e-05 -7.9e-06 1.72e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.415357022919999e-14 -3.765115089899999e-14 -5.59159645266e-14 ] [ -2.899939707539999e-14 -7.0495771896e-15 1.49002426962e-14 ] [ -1.26571954086e-14 5.735792349719999e-14 1.34582837256e-14 ] [ 9.581016271319999e-14 -1.26571954086e-14 2.75574381048e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.026357 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.606399490954234e-18 } }