{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0909404 0.3504436 2.335509 ] [ 2.174921 0.6476227 0.0631824 ] [ 2.07151 0.3484765 2.894541 ] [ 2.345183 1.577217 1.820601 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.09404e-12 3.504436000000001e-11 2.335509e-10 ] [ 2.174921e-10 6.476227e-11 6.31824e-12 ] [ 2.07151e-10 3.484765e-11 2.894541e-10 ] [ 2.345183e-10 1.577217e-10 1.820601e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.5573728 0.9530915 -2.5343737 ] [ -1.6939629 -2.6443536 -0.4545817 ] [ 0.5684549 -11.9056363 9.0984445 ] [ 1.6828807 13.5968984 -6.1094891 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.930096692298343e-10 1.527020918783203e-09 -4.060514290510394e-09 ] [ -2.714027754882568e-09 -4.236721515048315e-09 -7.283201719835194e-10 ] [ 9.107651507592019e-10 -1.907493213560781e-08 1.457731506354635e-08 ] [ 2.696272113135538e-09 2.178463273187293e-08 -9.788480601052434e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.9410596 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.43251566562994e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.2421186 0.672228 1.9685293 ] [ 2.0016858 0.2350752 0.4651536 ] [ 2.3222651 -0.0804749 2.7770727 ] [ 2.1164848 2.0969315 1.9030778 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.421186e-11 6.72228e-11 1.9685293e-10 ] [ 2.0016858e-10 2.350752e-11 4.651536e-11 ] [ 2.3222651e-10 -8.047490000000001e-12 2.7770727e-10 ] [ 2.1164848e-10 2.0969315e-10 1.9030778e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7e-07 -2e-06 -3e-06 ] [ -3.5e-06 -0.0 -1.3e-06 ] [ 2.3e-06 -5.7e-06 5.4e-06 ] [ 1.9e-06 7.6e-06 -1.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.12152363456e-15 -3.2043532416e-15 -4.8065298624e-15 ] [ -5.6076181728e-15 0.0 -2.08282960704e-15 ] [ 3.68500622784e-15 -9.13240673856e-15 8.65175375232e-15 ] [ 3.04413557952e-15 1.217654231808e-14 -1.76239428288e-15 ] ] } "relaxed-potential-energy" { "source-value" -15.645677 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.506713790598828e-18 } }