{ "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" [ [ 2.743488 1.903222 1.191758 ] [ 2.092285 1.109675 3.649357 ] [ 1.94045 3.241003 2.726585 ] [ 4.050079 0.1031898 2.277213 ] [ 5.000478 2.032764 2.106801 ] [ 4.158728 1.007331 4.48257 ] [ 3.981083 3.39009 3.613579 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.743488e-10 1.903222e-10 1.191758e-10 ] [ 2.092285e-10 1.109675e-10 3.649357e-10 ] [ 1.94045e-10 3.241003e-10 2.726585e-10 ] [ 4.050079e-10 1.031898e-11 2.277213e-10 ] [ 5.000478000000001e-10 2.032764e-10 2.106801e-10 ] [ 4.158728e-10 1.007331e-10 4.48257e-10 ] [ 3.981083e-10 3.39009e-10 3.613579e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.0088527 -0.6126523 -2.433991 ] [ -2.5371025 -1.0225075 0.5157027 ] [ -1.2117233 1.1652936 0.7372198 ] [ -0.5786166 -2.5824237 -0.0521725 ] [ 2.2702109 1.830716 -1.4242314 ] [ 1.1410247 0.3104692 1.2849857 ] [ 0.9073542 0.9111047 1.3724868 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.418358897095616e-11 -9.81577191739348e-10 -3.899683475437612e-09 ] [ -4.064886310073232e-09 -1.638237611092656e-09 8.262468092234361e-10 ] [ -1.941394742138625e-09 1.867006162287867e-09 1.181156327950852e-09 ] [ -9.270459889267854e-10 -4.137498877139833e-09 -8.358955974868799e-11 ] [ 3.637278828265327e-09 2.933130374524493e-09 -2.281870251689254e-09 ] [ 1.828123098095334e-09 4.974264937184794e-10 2.058774046602323e-09 ] [ 1.453741686024688e-09 1.459750649440998e-09 2.198966263316606e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -16.949297 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.715576739239558e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.8918965 1.9848878 0.9055361 ] [ 1.8589622 0.9014156 3.7796504 ] [ 2.0034779 3.0312646 2.8076041 ] [ 3.8501917 0.098918 2.365873 ] [ 5.1073539 2.2709441 1.8095902 ] [ 4.0744141 1.1874965 4.6837273 ] [ 4.1802948 3.3123483 3.6958819 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8918965e-10 1.9848878e-10 9.055361e-11 ] [ 1.8589622e-10 9.014156000000001e-11 3.7796504e-10 ] [ 2.0034779e-10 3.0312646e-10 2.8076041e-10 ] [ 3.8501917e-10 9.891800000000001e-12 2.365873e-10 ] [ 5.1073539e-10 2.2709441e-10 1.8095902e-10 ] [ 4.0744141e-10 1.1874965e-10 4.683727300000001e-10 ] [ 4.180294800000001e-10 3.3123483e-10 3.6958819e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.09e-05 7.7e-06 -7.2e-06 ] [ 1.97e-05 -3.93e-05 2.63e-05 ] [ -8.7e-06 5.24e-05 -4.28e-05 ] [ -1.11e-05 -3.42e-05 2.92e-05 ] [ 3.03e-05 3.75e-05 1.37e-05 ] [ -7.7e-06 -3.15e-05 -1.03e-05 ] [ 8.4e-06 7.4e-06 -8.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.950725758272e-14 1.233675998016e-14 -1.153567166976e-14 ] [ 3.156287942976e-14 -6.296554119743999e-14 4.213724512704e-14 ] [ -1.393893660096e-14 8.395405492992e-14 -6.857315937023999e-14 ] [ -1.778416049088e-14 -5.479444043136e-14 4.678355732736e-14 ] [ 4.854595161024e-14 6.008162327999999e-14 2.194981970496e-14 ] [ -1.233675998016e-14 -5.04685635552e-14 -1.650241919424e-14 ] [ 1.345828361472e-14 1.185610699392e-14 -1.425937192512e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.320543 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.93527456749611e-18 } }