{ "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" [ [ 1.662864 2.785445 0.9951273 ] [ 1.604551 1.254517 2.754062 ] [ 1.304297 2.979259 4.142484 ] [ 2.049326 4.702389 2.752286 ] [ 3.428978 2.585226 4.349041 ] [ 3.762165 3.432195 2.245626 ] [ 3.938407 4.831482 3.738967 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.662864e-10 2.785445e-10 9.951273000000001e-11 ] [ 1.604551e-10 1.254517e-10 2.754062e-10 ] [ 1.304297e-10 2.979259e-10 4.142484e-10 ] [ 2.049326e-10 4.702389e-10 2.752286e-10 ] [ 3.428978e-10 2.585226e-10 4.349041e-10 ] [ 3.762165e-10 3.432195e-10 2.245626e-10 ] [ 3.938407e-10 4.831482000000001e-10 3.738967e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.7008003 0.3065053 0.9901513 ] [ 0.2115747 0.1616907 -0.6034829 ] [ -2.2608269 0.4866774 0.8752845 ] [ -4.0431216 1.1500265 -1.4784608 ] [ 1.6453958 -1.4660432 1.2367641 ] [ 1.4793994 -3.0366769 -4.1289043 ] [ 2.2667783 2.3978202 3.1086481 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.12280586576019e-09 4.910756298571601e-10 1.586397276984724e-09 ] [ 3.389800406855598e-10 2.590570614751038e-10 -9.668862013985587e-10 ] [ -3.622244032698654e-09 7.797431585758715e-10 1.402360374002373e-09 ] [ -6.477794955940694e-09 1.842545586780801e-09 -2.368755348044947e-09 ] [ 2.636214704441737e-09 -2.348860159474589e-09 1.981514542790039e-09 ] [ 2.370259151033619e-09 -4.865292774187554e-09 -6.615233993482125e-09 ] [ 3.631779226718242e-09 3.841731496973207e-09 4.980603349148495e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -20.625785 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.304615078490769e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0262251 3.0743722 1.2098949 ] [ 1.6889821 1.4579662 2.8437237 ] [ 1.1637542 3.1299518 4.4002625 ] [ 1.4980102 4.7572305 2.7766217 ] [ 3.4706198 2.3890959 4.2097189 ] [ 4.2138397 3.044773 1.9905166 ] [ 3.6891569 4.7171233 3.5468549 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0262251e-10 3.0743722e-10 1.2098949e-10 ] [ 1.6889821e-10 1.4579662e-10 2.8437237e-10 ] [ 1.1637542e-10 3.1299518e-10 4.4002625e-10 ] [ 1.4980102e-10 4.7572305e-10 2.776621700000001e-10 ] [ 3.4706198e-10 2.3890959e-10 4.2097189e-10 ] [ 4.213839700000001e-10 3.044773e-10 1.9905166e-10 ] [ 3.6891569e-10 4.717123300000001e-10 3.5468549e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.3e-06 2.8e-06 1.18e-05 ] [ 4.6e-06 -3.94e-05 -5.4e-06 ] [ -1.08e-05 2.57e-05 3.61e-05 ] [ 3.7e-05 6e-07 -2.07e-05 ] [ -4e-06 1.08e-05 -3.96e-05 ] [ -1.7e-06 1.56e-05 4e-06 ] [ -2.63e-05 -1.6e-05 1.37e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.0828296242e-15 4.486094575199999e-15 1.89056842812e-14 ] [ 7.370012516399999e-15 -6.31257593796e-14 -8.6517538236e-15 ] [ -1.73035076472e-14 4.11759394938e-14 5.783857648740001e-14 ] [ 5.9280535458e-14 9.613059803999998e-16 -3.316505632379999e-14 ] [ -6.408706535999999e-15 1.73035076472e-14 -6.34461947064e-14 ] [ -2.7237002778e-15 2.49939554904e-14 6.408706535999999e-15 ] [ -4.21372454742e-14 -2.5634826144e-14 2.19498198858e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.96247 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.678993289292598e-18 } }