{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.2482594 0.208506 0.7144033 ] [ 0.1842271 0.5542422 2.415306 ] [ 0.3347056 2.949491 0.3757933 ] [ 2.042519 0.2544893 1.784175 ] [ 2.203059 1.053322 2.694572 ] [ 1.978392 2.822156 1.26577 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.482594e-11 2.08506e-11 7.144033e-11 ] [ 1.842271e-11 5.542422e-11 2.415306e-10 ] [ 3.347056e-11 2.949491e-10 3.757933e-11 ] [ 2.042519e-10 2.544893e-11 1.784175e-10 ] [ 2.203059e-10 1.053322e-10 2.694572e-10 ] [ 1.978392e-10 2.822156e-10 1.26577e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -15.6485456 -16.0717807 -107.294163 ] [ -21.4029858 15.6949584 96.3251732 ] [ -52.2965606 0.9424466 -27.9658376 ] [ -46.6268727 -363.8191293 -395.078 ] [ 82.1475773 366.9001397 402.0463127 ] [ 53.8273873 -3.6466346 31.9665147 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.507173411640351e-08 -2.574983150431216e-08 -1.719042009231873e-07 ] [ -3.429136374659379e-08 2.514609562008202e-08 1.54329941767043e-07 ] [ -8.378832743188502e-08 1.509965921312744e-09 -4.480621155295863e-08 ] [ -7.470448595643248e-08 -5.829025079666847e-07 -6.329847402074519e-07 ] [ 1.316149288897688e-07 5.878388308386757e-07 6.441492079937973e-07 ] [ 8.624098220132834e-08 -5.842552748855936e-09 5.121600292275751e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 190.99354 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.060053870329443e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.029682 0.3048386 0.6453342 ] [ -0.212129 0.7130339 3.1150081 ] [ 0.4261645 2.6426392 -0.0923109 ] [ 2.4161754 -0.3930661 1.0221285 ] [ 2.2414416 1.2335381 2.9321005 ] [ 2.0898275 3.3412228 1.6277593 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.9682e-12 3.048386e-11 6.453342e-11 ] [ -2.12129e-11 7.130339000000001e-11 3.1150081e-10 ] [ 4.261645e-11 2.6426392e-10 -9.23109e-12 ] [ 2.4161754e-10 -3.930661e-11 1.0221285e-10 ] [ 2.2414416e-10 1.2335381e-10 2.9321005e-10 ] [ 2.0898275e-10 3.3412228e-10 1.6277593e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.11e-05 4.61e-05 1.25e-05 ] [ 3.78e-05 -3.4e-06 -9.4e-06 ] [ -3.07e-05 2.25e-05 -4.68e-05 ] [ -2.95e-05 -1.45e-05 -6.9e-06 ] [ 1.8e-06 1.72e-05 4.89e-05 ] [ -3.05e-05 -6.79e-05 1.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.187122599739999e-14 7.386034282739999e-14 2.0027207925e-14 ] [ 6.056227676519999e-14 -5.4474005556e-15 -1.50604603596e-14 ] [ -4.91868226638e-14 3.6048974265e-14 -7.498186647119999e-14 ] [ -4.726421070299999e-14 -2.3231561193e-14 -1.10550187746e-14 ] [ 2.8839179412e-15 2.75574381048e-14 7.834643740259999e-14 ] [ -4.886638733699999e-14 -1.087877934486e-13 2.7237002778e-15 ] ] } "relaxed-potential-energy" { "source-value" -19.334204 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.097680988578933e-18 } }