{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.4009464 1.193297 0.9558509 ] [ 0.2244953 2.906435 0.4394059 ] [ 0.3187826 2.815079 2.795658 ] [ 1.502588 0.0124763 2.860219 ] [ 2.103704 2.743898 0.1444875 ] [ 2.704733 1.991532 2.940817 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.009464e-11 1.193297e-10 9.558509e-11 ] [ 2.244953e-11 2.906435e-10 4.394059e-11 ] [ 3.187826e-11 2.815079e-10 2.795658e-10 ] [ 1.502588e-10 1.24763e-12 2.860219e-10 ] [ 2.103704e-10 2.743898e-10 1.444875e-11 ] [ 2.704733e-10 1.991532e-10 2.940817e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 5.3421684 -27.7362652 11.1061746 ] [ -16.5656683 29.2808304 -5.1824619 ] [ 1.2995319 -1.1042903 -1.8953548 ] [ -1.4325255 1.2708487 -2.6060991 ] [ 12.636174 -2.6786754 -0.8366058 ] [ -1.2796806 0.9675517 -0.585653 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.559097314856543e-09 -4.443839565174864e-08 1.779405329064279e-08 ] [ -2.654112645818768e-08 4.691306190448991e-08 -8.303219294366748e-09 ] [ 2.082079628163804e-09 -1.769268101236218e-09 -3.03669314868106e-09 ] [ -2.29515886479983e-09 2.036124075714073e-09 -4.175431049507921e-09 ] [ 2.024538255916082e-08 -4.291711100592088e-09 -1.340390253585681e-09 ] [ -2.050274339411317e-09 1.550188713155295e-09 -9.383195445013824e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -8.9236846 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.4297318837513e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.2908157 0.9578459 1.0878446 ] [ 0.2023211 3.3986963 0.4739792 ] [ 0.1758239 2.7661168 2.7607876 ] [ 1.8145018 0.0238295 2.6492263 ] [ 2.2766739 2.248862 0.40122 ] [ 2.4951129 2.2673668 2.7633806 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.908157e-11 9.578459e-11 1.0878446e-10 ] [ 2.023211e-11 3.3986963e-10 4.739792e-11 ] [ 1.758239e-11 2.7661168e-10 2.7607876e-10 ] [ 1.8145018e-10 2.38295e-12 2.6492263e-10 ] [ 2.2766739e-10 2.248862e-10 4.0122e-11 ] [ 2.4951129e-10 2.2673668e-10 2.7633806e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.55e-05 1.24e-05 -1.81e-05 ] [ -7.6e-06 -2.81e-05 -9e-07 ] [ -9.7e-06 5.8e-06 1.43e-05 ] [ -9.4e-06 -3.8e-06 -1.47e-05 ] [ 1.02e-05 -8.1e-06 -7.1e-06 ] [ 3.21e-05 2.17e-05 2.65e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.48337376224e-14 1.986699009792e-14 -2.899939683648e-14 ] [ -1.217654231808e-14 -4.502116304448e-14 -1.44195895872e-15 ] [ -1.554111322176e-14 9.292624400640001e-15 2.291112567744e-14 ] [ -1.506046023552e-14 -6.08827115904e-15 -2.355199632576e-14 ] [ 1.634220153216e-14 -1.297763062848e-14 -1.137545400768e-14 ] [ 5.142986952768e-14 3.476723267136e-14 4.24576804512e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.046632 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.891389187458115e-18 } }