{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.0143447e-10 2.666651e-10 1.5684396e-10 ] [ 2.5692933e-10 2.2397711e-10 4.8108222e-10 ] [ 8.547532e-11 1.5536487e-10 3.2233792e-10 ] [ 2.4189898e-10 -1.013513e-11 3.9937371e-10 ] [ 3.7935028e-10 3.1994354e-10 2.9372159e-10 ] [ 4.5081886e-10 1.0685648e-10 3.790366e-10 ] ] "source-value" [ [ 2.0143447 2.666651 1.5684396 ] [ 2.5692933 2.2397711 4.8108222 ] [ 0.8547532 1.5536487 3.2233792 ] [ 2.4189898 -0.1013513 3.9937371 ] [ 3.7935028 3.1994354 2.9372159 ] [ 4.5081886 1.0685648 3.790366 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 5.711759653152e-13 1.57429874759808e-12 -2.31306238744896e-12 ] [ 7.2963123311232e-13 3.660973578528e-13 2.1533253783552e-12 ] [ 8.701421227564801e-13 1.02891782587776e-12 1.0958888086272e-13 ] [ -5.094921654144e-14 -3.3934100828544e-12 7.6455868344576e-13 ] [ -1.88624253566784e-12 6.4984283739648e-13 -1.37803211155008e-12 ] [ -2.339177866368e-13 -2.2574668587072e-13 6.6362155633536e-13 ] ] "source-value" [ [ 0.0003565 0.0009826 -0.0014437 ] [ 0.0004554 0.0002285 0.001344 ] [ 0.0005431 0.0006422 6.84e-05 ] [ -3.18e-05 -0.002118 0.0004772 ] [ -0.0011773 0.0004056 -0.0008601 ] [ -0.000146 -0.0001409 0.0004142 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.888116100839482e-18 "source-value" -18.026203 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.823289171012718e-09 -1.117172122857907e-10 1.322421362130422e-09 ] [ -1.520642653655798e-09 5.179894693404749e-10 -6.82513141306537e-10 ] [ -2.877520426193146e-09 1.276255443890381e-10 -9.059872998583143e-10 ] [ 1.46938469767953e-09 -2.46185604956967e-09 8.377340951592479e-10 ] [ 3.637112842767412e-09 3.82741890113305e-09 -5.019992660119047e-10 ] [ 1.11495471041472e-09 -1.89946049278944e-09 -6.965575011291457e-11 ] ] "source-value" [ [ -1.1380076 -0.0697284 0.8253905 ] [ -0.9491105 0.3233036 -0.4259912 ] [ -1.796007 0.0796576 -0.5654728 ] [ 0.9171178 -1.5365697 0.5228725 ] [ 2.2701073 2.388887 -0.3133233 ] [ 0.6959 -1.18555 -0.0434757 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.678994560892156e-18 "source-value" -16.720969 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.164327e-10 2.183765e-10 1.328393e-10 ] [ 2.70587e-10 2.068279e-10 5.162644000000001e-10 ] [ 8.559813e-11 1.907046e-10 3.441903e-10 ] [ 2.386273e-10 2.061938e-11 3.516969e-10 ] [ 3.489815e-10 3.035472e-10 2.979319e-10 ] [ 4.556806e-10 1.225964e-10 3.894732e-10 ] ] "source-value" [ [ 2.164327 2.183765 1.328393 ] [ 2.70587 2.068279 5.162644 ] [ 0.8559813 1.907046 3.441903 ] [ 2.386273 0.2061938 3.516969 ] [ 3.489815 3.035472 2.979319 ] [ 4.556806 1.225964 3.894732 ] ] } "instance-id" 1 }