{ "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" [ [ 2.539099 2.604661 3.099024 ] [ 2.611969 4.601789 1.586924 ] [ 4.376067 2.909228 1.297188 ] [ 4.596034 1.971363 3.954157 ] [ 4.509814 4.398854 3.387028 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.539099e-10 2.604661e-10 3.099024e-10 ] [ 2.611969e-10 4.601789e-10 1.586924e-10 ] [ 4.376067e-10 2.909228e-10 1.297188e-10 ] [ 4.596034e-10 1.971363e-10 3.954157e-10 ] [ 4.509814000000001e-10 4.398854e-10 3.387028e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.3776914 0.7855201 -0.8146175 ] [ 1.1338833 -1.132038 1.0277302 ] [ -0.7359368 0.5616919 1.4713132 ] [ 0.0152608 1.0021618 -0.7116916 ] [ -0.7908988 -1.2173358 -0.9727343 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.051283309572212e-10 1.258541939388478e-09 -1.305161113394544e-09 ] [ 1.816681313975553e-09 -1.813724817457191e-09 1.646605298930108e-09 ] [ -1.179100735346365e-09 8.999296302727316e-10 2.357303610914435e-09 ] [ 2.445049697470464e-11 1.605640206218845e-09 -1.140255642739745e-09 ] [ -1.267159566778775e-09 -1.950386958422865e-09 -1.558492153710254e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.0185737754089 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.04064157272013e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.4779226 2.7058976 3.11506 ] [ 2.7903719 4.5079607 1.6583863 ] [ 4.3745709 2.799382 1.4632857 ] [ 4.662813 2.0864002 3.6713632 ] [ 4.3273045 4.3862544 3.4162259 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4779226e-10 2.7058976e-10 3.11506e-10 ] [ 2.7903719e-10 4.5079607e-10 1.6583863e-10 ] [ 4.3745709e-10 2.799382e-10 1.4632857e-10 ] [ 4.662813e-10 2.0864002e-10 3.6713632e-10 ] [ 4.327304500000001e-10 4.386254400000001e-10 3.4162259e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.71e-05 -2.28e-05 4.68e-05 ] [ -2.73e-05 6.63e-05 -5.74e-05 ] [ 2.42e-05 -3.1e-05 3.61e-05 ] [ -1.34e-05 1.45e-05 -4.24e-05 ] [ -1.06e-05 -2.7e-05 1.69e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.341898642368e-14 -3.652962695424e-14 7.498186585344001e-14 ] [ -4.373942174784e-14 1.0622430995904e-13 -9.196493803392e-14 ] [ 3.877267422336e-14 -4.96674752448e-14 5.783857601088001e-14 ] [ -2.146916671872e-14 2.32315610016e-14 -6.793228872192001e-14 ] [ -1.698307218048e-14 -4.32587687616e-14 2.707678489152e-14 ] ] } "relaxed-potential-energy" { "source-value" -5.7659997754089005 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.238150035698192e-19 } }