{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.3288529 1.174724 0.8712814 ] [ 1.395659 1.176494 2.521247 ] [ 2.395391 0.4245255 0.3168768 ] [ 2.017962 2.536207 0.5333854 ] [ 2.744316 1.992854 1.84914 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.288529e-11 1.174724e-10 8.712814e-11 ] [ 1.395659e-10 1.176494e-10 2.521247e-10 ] [ 2.395391e-10 4.245255e-11 3.168768e-11 ] [ 2.017962e-10 2.536207e-10 5.333854e-11 ] [ 2.744316e-10 1.992854e-10 1.84914e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -42.6288198 8.8865991 -50.361117 ] [ -229.3677538 -155.359124 183.2120175 ] [ 19.70159 -29.9846687 -8.2539386 ] [ -390.6834783 302.3021109 -680.0342425 ] [ 642.9784619 -125.8449173 555.4372806 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.829889845585613e-08 1.423790131644232e-08 -8.068740425477344e-08 ] [ -3.674876527037704e-07 -2.489127563007682e-07 2.935380110881005e-07 ] [ 3.156542689058707e-08 -4.804073517357353e-08 -1.322426745443868e-08 ] [ -6.259439350650841e-07 4.843413745024689e-07 -1.089534964676938e-06 ] [ 1.030165059334123e-06 -2.016257843445695e-07 8.899086252980495e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 222.70589 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.568141702724565e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.2297543 1.0249376 0.7970923 ] [ 0.9970915 1.1572032 3.2298152 ] [ 2.6308351 0.3294516 -0.0448998 ] [ 1.8624701 2.9590108 0.0544868 ] [ 3.1620299 1.8342014 2.0554361 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.297543e-11 1.0249376e-10 7.970923e-11 ] [ 9.970915000000001e-11 1.1572032e-10 3.2298152e-10 ] [ 2.6308351e-10 3.294516e-11 -4.48998e-12 ] [ 1.8624701e-10 2.9590108e-10 5.44868e-12 ] [ 3.1620299e-10 1.8342014e-10 2.0554361e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.86e-05 1.1e-05 -2.47e-05 ] [ 1.03e-05 3.9e-06 1.81e-05 ] [ 9.2e-06 5e-06 -7.8e-06 ] [ -8.1e-06 -2.18e-05 3.9e-06 ] [ 7.2e-06 1.9e-06 1.05e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.980048514688e-14 1.76239428288e-14 -3.957376253376001e-14 ] [ 1.650241919424e-14 6.24848882112e-15 2.899939683648e-14 ] [ 1.474002491136e-14 8.010883104e-15 -1.249697764224e-14 ] [ -1.297763062848e-14 -3.492745033344e-14 6.24848882112e-15 ] [ 1.153567166976e-14 3.04413557952e-15 1.68228545184e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.556674 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.652671600100722e-18 } }