{ "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" [ [ 2.689863 2.613928 1.941703 ] [ 2.080356 5.103994 1.950756 ] [ 1.651882 3.89841 3.770183 ] [ 3.604737 2.326315 3.946353 ] [ 4.359532 3.977463 2.369793 ] [ 3.455978 5.487629 3.928773 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.689863e-10 2.613928e-10 1.941703e-10 ] [ 2.080356e-10 5.103994e-10 1.950756e-10 ] [ 1.651882e-10 3.89841e-10 3.770183e-10 ] [ 3.604737e-10 2.326315e-10 3.946353e-10 ] [ 4.359532e-10 3.977463000000001e-10 2.369793e-10 ] [ 3.455978e-10 5.487629000000001e-10 3.928773e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.2467409 -1.6686469 -2.7185651 ] [ -0.476848 1.3050537 -2.3017933 ] [ -2.1218469 -1.1172606 2.4988872 ] [ 0.6630665 -1.312142 2.3558308 ] [ 3.4808004 1.4998124 -0.8433835 ] [ 0.7015689 1.2931834 1.009024 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.599675742975151e-09 -2.673467051550396e-09 -4.355621445342814e-09 ] [ -7.639947172752384e-10 2.090926527028537e-09 -3.687879411174081e-09 ] [ -3.399573496096956e-09 -1.790048812660981e-09 4.003658649856374e-09 ] [ 1.062349644335683e-09 -2.102283235569754e-09 3.774457030320561e-09 ] [ 5.576857022551289e-09 2.402964362865938e-09 -1.351249326068477e-09 ] [ 1.124037289460373e-09 2.071908209886655e-09 1.616634662626099e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.354261 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.979370814146123e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.9794934 2.9341464 1.3933582 ] [ 1.5995186 4.7432993 2.051846 ] [ 1.8061902 4.0357303 4.4289673 ] [ 3.1861484 2.2265663 3.7704773 ] [ 4.8254821 3.8294175 2.8022165 ] [ 3.4455154 5.6385792 3.4606957 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.9794934e-10 2.9341464e-10 1.3933582e-10 ] [ 1.5995186e-10 4.743299300000001e-10 2.051846e-10 ] [ 1.8061902e-10 4.0357303e-10 4.4289673e-10 ] [ 3.1861484e-10 2.2265663e-10 3.7704773e-10 ] [ 4.8254821e-10 3.8294175e-10 2.8022165e-10 ] [ 3.4455154e-10 5.6385792e-10 3.4606957e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.3e-06 -4.2e-06 -3.7e-06 ] [ 1.13e-05 2.6e-06 1.7e-06 ] [ -9e-06 -4.8e-06 1.7e-06 ] [ 3.5e-06 4.4e-06 3.7e-06 ] [ 2.1e-06 3.4e-06 -3.4e-06 ] [ -6e-07 -1.4e-06 1e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.169588933184e-14 -6.72914180736e-15 -5.928053496960001e-15 ] [ 1.810459581504e-14 4.16565921408e-15 2.72370025536e-15 ] [ -1.44195895872e-14 -7.69044777984e-15 2.72370025536e-15 ] [ 5.6076181728e-15 7.04957713152e-15 5.928053496960001e-15 ] [ 3.36457090368e-15 5.44740051072e-15 -5.44740051072e-15 ] [ -9.6130597248e-16 -2.24304726912e-15 1.6021766208e-16 ] ] } "relaxed-potential-energy" { "source-value" -14.328753 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.295719306181786e-18 } }