{ "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" [ [ 1.971858 1.613185 3.540739 ] [ 1.980532 3.696797 1.101352 ] [ 1.421419 3.841396 3.166588 ] [ 2.933735 5.314328 3.389927 ] [ 3.610376 2.128489 1.767833 ] [ 4.452161 4.502678 1.60274 ] [ 4.038762 3.260824 3.402783 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.971858e-10 1.613185e-10 3.540739e-10 ] [ 1.980532e-10 3.696797e-10 1.101352e-10 ] [ 1.421419e-10 3.841396e-10 3.166588e-10 ] [ 2.933735e-10 5.314328e-10 3.389927e-10 ] [ 3.610376e-10 2.128489e-10 1.767833e-10 ] [ 4.452161e-10 4.502678000000001e-10 1.60274e-10 ] [ 4.038762e-10 3.260824e-10 3.402783e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.6655618 -0.0266651 -0.096764 ] [ 0.2936344 0.5775551 -3.9167792 ] [ -3.8947157 -1.849354 2.5284404 ] [ 2.6568199 3.1033487 0.2394844 ] [ -0.8631466 -4.1047355 -4.6774838 ] [ -0.7287801 0.634925 -0.8663257 ] [ 1.8706263 1.6649259 6.7894279 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.066347555657565e-09 -4.272219981129408e-11 -1.550330185350912e-10 ] [ 4.704541707426355e-10 9.253452784438061e-10 -6.275372063075727e-09 ] [ -6.240022439202706e-09 -2.962991742382963e-09 4.0510080959662e-09 ] [ 4.256694729456194e-09 4.972112733330073e-09 3.836963067263155e-10 ] [ -1.382913302843009e-09 -6.576511252667799e-09 -7.494155188530743e-09 ] [ -1.167634437924286e-09 1.01726199096144e-09 -1.388006782538195e-09 ] [ 2.997073724113607e-09 2.667505352344399e-09 1.087786264998724e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -5.687538158928927 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.112440668143802e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.1879816 1.6303978 3.522555 ] [ 2.0204612 3.6847225 0.87275 ] [ 1.4062325 3.8594114 3.1730755 ] [ 3.1394055 5.4720896 3.4847712 ] [ 3.5709609 2.0215594 1.5910381 ] [ 4.1712028 4.4450472 1.5672154 ] [ 3.9125985 3.244469 3.7605569 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1879816e-10 1.6303978e-10 3.522555e-10 ] [ 2.0204612e-10 3.6847225e-10 8.7275e-11 ] [ 1.4062325e-10 3.8594114e-10 3.1730755e-10 ] [ 3.1394055e-10 5.4720896e-10 3.4847712e-10 ] [ 3.5709609e-10 2.0215594e-10 1.5910381e-10 ] [ 4.1712028e-10 4.445047200000001e-10 1.5672154e-10 ] [ 3.9125985e-10 3.244469e-10 3.7605569e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.93e-05 4.21e-05 6.21e-05 ] [ -4.63e-05 -3.32e-05 8.5e-06 ] [ 3.94e-05 1.02e-05 -8.45e-05 ] [ -2.06e-05 -4.12e-05 4.56e-05 ] [ 2.3e-06 -1.01e-05 -3.95e-05 ] [ 2.12e-05 4.58e-05 9.5e-06 ] [ 2.33e-05 -1.36e-05 -1.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.092200878144e-14 6.745163573568001e-14 9.949516815168001e-14 ] [ -7.418077754303999e-14 -5.319226381056e-14 1.36185012768e-14 ] [ 6.312575885952001e-14 1.634220153216e-14 -1.353839244576e-13 ] [ -3.300483838848e-14 -6.600967677696001e-14 7.305925390848e-14 ] [ 3.68500622784e-15 -1.618198387008e-14 -6.32859765216e-14 ] [ 3.396614436096001e-14 7.337968923264e-14 1.52206778976e-14 ] [ 3.733071526464e-14 -2.178960204288e-14 -2.72370025536e-15 ] ] } "relaxed-potential-energy" { "source-value" -8.097630158928926 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.297383372452091e-18 } }