{ "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" [ [ 1.999551 1.685791 2.486539 ] [ 2.806467 1.943327 4.558328 ] [ 1.52714 3.922099 3.002179 ] [ 4.336396 2.072479 2.061694 ] [ 5.046676 1.88237 4.081611 ] [ 3.556935 4.352885 1.849563 ] [ 3.300335 4.140991 4.307093 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.999551e-10 1.685791e-10 2.486539e-10 ] [ 2.806467e-10 1.943327e-10 4.558328e-10 ] [ 1.52714e-10 3.922099e-10 3.002179e-10 ] [ 4.336396e-10 2.072479e-10 2.061694e-10 ] [ 5.046676e-10 1.88237e-10 4.081611e-10 ] [ 3.556935e-10 4.352885e-10 1.849563e-10 ] [ 3.300335e-10 4.140991e-10 4.307093e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.9563319 -2.2372589 -2.1833049 ] [ -0.561242 0.7953252 -1.6767115 ] [ -3.7530629 -1.2723248 1.2304139 ] [ -0.8509789 -0.2589085 0.1698249 ] [ 0.2607395 2.1133265 2.1128279 ] [ 2.3324895 1.2777984 -3.5624515 ] [ 4.5283866 -0.4179578 3.9094012 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.134389232705243e-09 -3.584483904256726e-09 -3.498040066858082e-09 ] [ -8.992088110110336e-10 1.274251441373084e-09 -2.686387965126499e-09 ] [ -6.013069634771849e-09 -2.038489048624036e-09 1.971340384487349e-09 ] [ -1.363418498374101e-09 -4.148171456263968e-10 2.720894844096979e-10 ] [ 4.177507310190816e-10 3.385922310417091e-09 3.385123465153961e-09 ] [ 3.737060145161481e-09 2.047258722575647e-09 -5.707676506033891e-09 ] [ 7.255275140464002e-09 -6.696422156410022e-10 6.263551203967466e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -20.963658 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.358748273404689e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.8768136 2.0170894 1.8634369 ] [ 2.7795553 1.8837163 4.2593028 ] [ 1.4301425 3.8749165 3.3721114 ] [ 4.1863375 1.3201893 2.1913747 ] [ 5.1670289 2.7472775 3.9027437 ] [ 3.6700123 3.8305581 2.1255598 ] [ 3.4636099 4.326195 4.6324778 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8768136e-10 2.0170894e-10 1.8634369e-10 ] [ 2.7795553e-10 1.8837163e-10 4.259302800000001e-10 ] [ 1.4301425e-10 3.8749165e-10 3.3721114e-10 ] [ 4.1863375e-10 1.3201893e-10 2.1913747e-10 ] [ 5.1670289e-10 2.7472775e-10 3.9027437e-10 ] [ 3.6700123e-10 3.8305581e-10 2.1255598e-10 ] [ 3.4636099e-10 4.326195e-10 4.6324778e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.2e-06 4.7e-05 2.4e-06 ] [ -1.17e-05 -8.3e-05 2.27e-05 ] [ -2.18e-05 2.07e-05 4.51e-05 ] [ 2.81e-05 -8.55e-05 2.3e-06 ] [ -6.1e-06 3.37e-05 -2.02e-05 ] [ 5.16e-05 3.44e-05 -5.84e-05 ] [ -3.8e-05 3.27e-05 6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.52478856576e-15 7.530230117759999e-14 3.84522388992e-15 ] [ -1.874546646336e-14 -1.329806595264e-13 3.636940929216e-14 ] [ -3.492745033344e-14 3.316505605055999e-14 7.225816559807999e-14 ] [ 4.502116304448e-14 -1.369861010784e-13 3.68500622784e-15 ] [ -9.77327738688e-15 5.399335212096e-14 -3.236396774016e-14 ] [ 8.267231363328e-14 5.511487575552001e-14 -9.356711465472001e-14 ] [ -6.08827115904e-14 5.239117550016001e-14 9.6130597248e-15 ] ] } "relaxed-potential-energy" { "source-value" -26.557231 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.254937462138501e-18 } }