{ "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" [ [ 1.232696 1.429874 2.018017 ] [ 2.664166 0.3933008 4.008788 ] [ 2.480457 2.487888 4.841749 ] [ 1.659099 3.474448 2.765735 ] [ 4.127261 1.03872 2.31822 ] [ 4.538799 1.714568 4.545045 ] [ 3.952007 3.51716 3.378238 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.232696e-10 1.429874e-10 2.018017e-10 ] [ 2.664166e-10 3.933008e-11 4.008788e-10 ] [ 2.480457e-10 2.487888e-10 4.841749e-10 ] [ 1.659099e-10 3.474448e-10 2.765735e-10 ] [ 4.127261e-10 1.03872e-10 2.31822e-10 ] [ 4.538799e-10 1.714568e-10 4.545045e-10 ] [ 3.952007e-10 3.51716e-10 3.378238e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.4245228 -3.8864337 3.5116126 ] [ -6.2277597 -2.7879757 -4.6112552 ] [ -6.362228 3.0654035 4.4786681 ] [ -0.9894388 1.8187827 -0.2086326 ] [ 1.3052284 -0.2455626 -3.0186667 ] [ 7.7508045 -2.8228607 3.3777139 ] [ 2.0988708 4.8586466 -3.5294402 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.884513778760255e-09 -6.226753263730166e-09 5.626223655379987e-09 ] [ -9.977971073506848e-09 -4.466829522699793e-09 -7.388045334850997e-09 ] [ -1.019341304178055e-08 4.911317861481818e-09 7.175617381261175e-09 ] [ -1.585255726132999e-09 2.914011144263432e-09 -3.342662768106684e-10 ] [ 2.091206444513205e-09 -3.934346599042883e-10 -4.836437252573886e-09 ] [ 1.241815786460205e-08 -4.522721454576884e-09 5.411694286917012e-09 ] [ 3.362761753544886e-09 7.784410055383544e-09 -5.654786619540286e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.096752 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.938113340169277e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.9562026 1.6650734 2.049181 ] [ 2.1835255 0.0833937 3.3421478 ] [ 2.4971561 1.9896366 4.8385351 ] [ 1.6586147 3.6179121 3.2208648 ] [ 4.5584988 0.1891185 3.1744404 ] [ 4.8369293 2.3156822 4.2136692 ] [ 3.963558 4.1951422 3.0369537 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.562026000000001e-11 1.6650734e-10 2.049181e-10 ] [ 2.1835255e-10 8.33937e-12 3.3421478e-10 ] [ 2.4971561e-10 1.9896366e-10 4.8385351e-10 ] [ 1.6586147e-10 3.6179121e-10 3.2208648e-10 ] [ 4.5584988e-10 1.891185e-11 3.1744404e-10 ] [ 4.8369293e-10 2.3156822e-10 4.2136692e-10 ] [ 3.963558e-10 4.195142200000001e-10 3.0369537e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.2e-06 1.44e-05 2e-05 ] [ 7.7e-06 -2.06e-05 9.8e-06 ] [ 4.5e-06 -9e-07 -2.77e-05 ] [ -4.17e-05 3.1e-06 -1.74e-05 ] [ -5.3e-06 -1.14e-05 -2.4e-06 ] [ 8e-07 1.49e-05 -2.3e-06 ] [ 3.08e-05 5e-07 2e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.1269652288e-15 2.30713435296e-14 3.204353268e-14 ] [ 1.23367600818e-14 -3.300483866039999e-14 1.57013310132e-14 ] [ 7.209794853e-15 -1.4419589706e-15 -4.438029276179999e-14 ] [ -6.681076563779999e-14 4.9667475654e-15 -2.78778734316e-14 ] [ -8.4915361602e-15 -1.82648136276e-14 -3.845223921599999e-15 ] [ 1.2817413072e-15 2.38724318466e-14 -3.685006258199999e-15 ] [ 4.93470403272e-14 8.010883169999999e-16 3.204353268e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.392428 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.946791838412735e-18 } }