{ "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" [ [ 2.682391 2.686577 1.562325 ] [ 1.212844 1.781832 3.455784 ] [ 1.883235 4.08794 3.099932 ] [ 4.668223 1.307552 1.415877 ] [ 3.293332 1.297731 3.803317 ] [ 4.485506 3.146522 2.925064 ] [ 3.343094 3.696236 5.003524 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.682391e-10 2.686577e-10 1.562325e-10 ] [ 1.212844e-10 1.781832e-10 3.455784e-10 ] [ 1.883235e-10 4.08794e-10 3.099932e-10 ] [ 4.668223000000001e-10 1.307552e-10 1.415877e-10 ] [ 3.293332e-10 1.297731e-10 3.803317e-10 ] [ 4.485506e-10 3.146522e-10 2.925064e-10 ] [ 3.343094e-10 3.696236e-10 5.003524e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.3522605 2.5860146 -12.6450713 ] [ -6.3545117 -3.4287949 1.449551 ] [ -7.2202599 9.144978 0.9345917 ] [ 4.0005644 -4.3204235 -4.2762192 ] [ 2.284109 -11.6504481 9.0868752 ] [ 10.9622542 4.8762668 0.7828144 ] [ 0.6801044 2.7924073 4.6674583 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.973090020731318e-09 4.143252133167464e-09 -2.025963760520906e-08 ] [ -1.018105008234006e-08 -5.493535026298275e-09 2.322436722857261e-09 ] [ -1.156813160787975e-08 1.465186994933034e-08 1.497380971733728e-09 ] [ 6.40961075168478e-09 -6.922081523654909e-09 -6.851258427656079e-09 ] [ 3.659546039158867e-09 -1.866607556766378e-08 1.455877900156732e-08 ] [ 1.756346739050661e-08 7.81264066374323e-09 1.25420693010558e-09 ] [ 1.089647369383212e-09 4.473929691811251e-09 7.478092566818913e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -0.62621489 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.003306856354844e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.6048446 3.0458868 1.0009592 ] [ 0.8791116 1.5647562 3.6686228 ] [ 1.5995151 3.8018343 3.0447332 ] [ 4.2989762 1.604887 1.9023981 ] [ 3.2142556 1.0094546 4.048482 ] [ 5.4310212 3.4324839 3.038682 ] [ 3.5409008 3.5450872 4.5619457 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6048446e-10 3.0458868e-10 1.0009592e-10 ] [ 8.791116000000001e-11 1.5647562e-10 3.6686228e-10 ] [ 1.5995151e-10 3.8018343e-10 3.0447332e-10 ] [ 4.2989762e-10 1.604887e-10 1.9023981e-10 ] [ 3.2142556e-10 1.0094546e-10 4.048482e-10 ] [ 5.4310212e-10 3.4324839e-10 3.038682e-10 ] [ 3.5409008e-10 3.5450872e-10 4.5619457e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.1e-06 2.08e-05 -4.28e-05 ] [ -9.3e-06 -1.29e-05 1.66e-05 ] [ 1.57e-05 8.2e-06 -3.9e-06 ] [ 6e-06 -1.01e-05 1.12e-05 ] [ 1.03e-05 1.25e-05 8.4e-06 ] [ -1.18e-05 -3e-07 -1.26e-05 ] [ -9.7e-06 -1.81e-05 2.32e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.76239428288e-15 3.332527371264e-14 -6.857315937023999e-14 ] [ -1.490024257344e-14 -2.066807840832e-14 2.659613190528e-14 ] [ 2.515417294656e-14 1.313784829056e-14 -6.24848882112e-15 ] [ 9.6130597248e-15 -1.618198387008e-14 1.794437815296e-14 ] [ 1.650241919424e-14 2.002720776e-14 1.345828361472e-14 ] [ -1.890568412544e-14 -4.8065298624e-16 -2.018742542208e-14 ] [ -1.554111322176e-14 -2.899939683648e-14 3.717049760256e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.129296 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.783109785716296e-18 } }