{ "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" [ [ 1.743709 2.680969 1.034902 ] [ 2.749822 1.528948 3.390438 ] [ 1.938557 3.742026 2.98984 ] [ 3.932402 1.721019 1.334077 ] [ 5.171354 1.721023 3.429234 ] [ 4.220666 3.803748 1.650722 ] [ 4.237092 3.532846 4.042988 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.743709e-10 2.680969e-10 1.034902e-10 ] [ 2.749822e-10 1.528948e-10 3.390438e-10 ] [ 1.938557e-10 3.742026e-10 2.98984e-10 ] [ 3.932402e-10 1.721019e-10 1.334077e-10 ] [ 5.171354e-10 1.721023e-10 3.429234e-10 ] [ 4.220666e-10 3.803748e-10 1.650722e-10 ] [ 4.237092e-10 3.532846e-10 4.042988e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.8541361 -0.959162 -3.6216294 ] [ -3.6877658 -5.09003 4.1147054 ] [ -2.797099 4.6333789 3.7438254 ] [ 1.743167 -10.4539946 -7.3802331 ] [ 4.6304914 -4.9554292 -1.0387698 ] [ 3.2436857 9.2721196 -1.3678474 ] [ -1.2783431 7.5531173 5.5499489 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.970653511201291e-09 -1.53674693195977e-09 -5.802489953881932e-09 ] [ -5.908452147745809e-09 -8.155127065170624e-09 6.592484793359513e-09 ] [ -4.481446623863059e-09 7.423491348888021e-09 5.998269528237208e-09 ] [ 2.792861413550074e-09 -1.674914574208945e-08 -1.182443692887431e-08 ] [ 7.418865063895461e-09 -7.939472810269648e-09 -1.664292687953092e-09 ] [ 5.196957393763283e-09 1.485557324838145e-08 -2.191533125102066e-09 ] [ -2.048131428180997e-09 1.210142795222002e-08 8.891998374214678e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.976793 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.91889377367611e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.5986421 2.3561701 0.6470988 ] [ 2.7757861 1.7751011 3.7371266 ] [ 1.6524587 3.8391985 2.676762 ] [ 3.9667134 1.8052173 1.3169192 ] [ 5.2902475 1.153837 3.4018557 ] [ 4.0415909 4.3156674 1.8984064 ] [ 4.6681633 3.4853877 4.1940324 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5986421e-10 2.3561701e-10 6.470988e-11 ] [ 2.7757861e-10 1.7751011e-10 3.7371266e-10 ] [ 1.6524587e-10 3.8391985e-10 2.676762e-10 ] [ 3.9667134e-10 1.8052173e-10 1.3169192e-10 ] [ 5.290247500000001e-10 1.153837e-10 3.4018557e-10 ] [ 4.0415909e-10 4.3156674e-10 1.8984064e-10 ] [ 4.6681633e-10 3.4853877e-10 4.1940324e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.6e-06 -2.54e-05 -3.2e-06 ] [ 7e-06 1.34e-05 1.9e-05 ] [ 3.61e-05 2.21e-05 -1.5e-06 ] [ -1.76e-05 6.4e-06 -3.02e-05 ] [ 4.1e-06 2.23e-05 -2.13e-05 ] [ -1.17e-05 -1.68e-05 -2.16e-05 ] [ -2.25e-05 -2.2e-05 5.88e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.370012455680001e-15 -4.069528616832e-14 -5.126965186560001e-15 ] [ 1.12152363456e-14 2.146916671872e-14 3.04413557952e-14 ] [ 5.783857601088001e-14 3.540810331968e-14 -2.4032649312e-15 ] [ -2.819830852608e-14 1.025393037312e-14 -4.838573394816e-14 ] [ 6.568924145279999e-15 3.572853864384e-14 -3.412636202304e-14 ] [ -1.874546646336e-14 -2.691656722944e-14 -3.460701500928e-14 ] [ -3.604897396800001e-14 -3.52478856576e-14 9.420798530304e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.566154 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.814408125617241e-18 } }