{ "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" [ [ 2.836172 2.264881 3.605889 ] [ 1.711544 3.356754 1.507539 ] [ 2.817956 4.908146 3.003841 ] [ 0.8092812 3.284881 3.852119 ] [ 4.796821 1.314646 2.655969 ] [ 4.297416 3.615744 1.848977 ] [ 4.570903 3.768738 4.135906 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.836172e-10 2.264881e-10 3.605889e-10 ] [ 1.711544e-10 3.356754e-10 1.507539e-10 ] [ 2.817956e-10 4.908146e-10 3.003841e-10 ] [ 8.092812000000001e-11 3.284881e-10 3.852119e-10 ] [ 4.796821e-10 1.314646e-10 2.655969e-10 ] [ 4.297416000000001e-10 3.615744e-10 1.848977e-10 ] [ 4.570903000000001e-10 3.768738e-10 4.135906000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.2275829 -2.7155284 1.4025056 ] [ -0.1568073 -0.0141254 0.1039588 ] [ -1.9963155 2.5126987 0.9305577 ] [ -0.3645981 0.6575475 -0.6524836 ] [ -0.1561008 0.746849 -0.2848004 ] [ 1.803131 -1.3679349 -3.564969 ] [ 1.0982735 0.1804935 2.0652309 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.646280016738643e-10 -4.350756115598431e-09 2.247061682861077e-09 ] [ -2.512329900307718e-10 -2.263138563944832e-11 1.665603588864231e-10 ] [ -3.198450021840663e-09 4.025787112254553e-09 1.49091779124542e-09 ] [ -5.841505518081005e-10 1.053507231565488e-09 -1.045393969375419e-09 ] [ -2.501010522481767e-10 1.196584007067859e-09 -4.563005424744884e-10 ] [ 2.888934332439725e-09 -2.191673315556386e-09 -5.711709985676756e-09 ] [ 1.759628124944189e-09 2.891824659063648e-10 3.308864664533743e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -18.727041 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.000402726696305e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.1804477 2.0282468 4.3361162 ] [ 2.1705587 3.8996666 1.3887929 ] [ 2.3181084 5.1983254 3.4616084 ] [ 1.2607178 2.9877696 3.4725351 ] [ 4.2371122 1.1053768 2.5082953 ] [ 4.3716257 3.2221379 1.6080678 ] [ 4.3015227 4.0722668 3.8348243 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.1804477e-10 2.0282468e-10 4.3361162e-10 ] [ 2.1705587e-10 3.8996666e-10 1.3887929e-10 ] [ 2.3181084e-10 5.1983254e-10 3.4616084e-10 ] [ 1.2607178e-10 2.9877696e-10 3.4725351e-10 ] [ 4.2371122e-10 1.1053768e-10 2.5082953e-10 ] [ 4.3716257e-10 3.2221379e-10 1.6080678e-10 ] [ 4.3015227e-10 4.0722668e-10 3.8348243e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.62e-05 7.36e-05 3.19e-05 ] [ -3.4e-06 -5.6e-06 2.99e-05 ] [ -1.65e-05 -1.28e-05 -4.37e-05 ] [ -4.4e-06 -2.64e-05 -2.88e-05 ] [ -3.2e-05 5.62e-05 -3.76e-05 ] [ -3.4e-06 -5.7e-06 2.38e-05 ] [ 3.34e-05 -7.93e-05 2.45e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.197702746496e-14 1.1792019929088e-13 5.110943420352001e-14 ] [ -5.44740051072e-15 -8.972189076479999e-15 4.790508096192e-14 ] [ -2.64359142432e-14 -2.050786074624e-14 -7.001511832895999e-14 ] [ -7.04957713152e-15 -4.229746278912e-14 -4.614268667904e-14 ] [ -5.12696518656e-14 9.004232608896e-14 -6.024184094208e-14 ] [ -5.44740051072e-15 -9.13240673856e-15 3.813180357504e-14 ] [ 5.351269913472e-14 -1.2705260602944e-13 3.92533272096e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.541842 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.611601224216751e-18 } }