{ "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" [ [ 1.232696 1.429874 2.018017 ] [ 2.664166 0.3933008 4.008788 ] [ 2.480457 2.487888 4.841749 ] [ 1.659099 3.474448 2.765735 ] [ 4.127261 1.03872 2.31822 ] [ 4.538799 1.714568 4.545045 ] [ 3.952007 3.51716 3.378238 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.232696e-10 1.429874e-10 2.018017e-10 ] [ 2.664166e-10 3.933008e-11 4.008788e-10 ] [ 2.480457e-10 2.487888e-10 4.841749e-10 ] [ 1.659099e-10 3.474448e-10 2.765735e-10 ] [ 4.127261e-10 1.03872e-10 2.31822e-10 ] [ 4.538799e-10 1.714568e-10 4.545045e-10 ] [ 3.952007e-10 3.51716e-10 3.378238e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 6.131111 -3.0914407 1.9394434 ] [ -5.5237591 -4.1237851 -1.9773181 ] [ -5.289857 1.5049817 5.6706058 ] [ -1.9460726 1.7315901 -1.5560154 ] [ -4.030475 1.8023042 -4.2934579 ] [ 7.1050964 -1.1598839 4.1699538 ] [ 3.5539563 3.3362339 -3.9532116 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.823122703729708e-09 -4.953034014129586e-09 3.107330872844863e-09 ] [ -8.85003768895125e-09 -6.60703207642339e-09 -3.168012831704676e-09 ] [ -8.475285212775225e-09 2.41124649447184e-09 9.08531203853288e-09 ] [ -3.11795202209947e-09 2.774313175028734e-09 -2.493011495484761e-09 ] [ -6.457532815718881e-09 2.887609652809648e-09 -6.878877869769064e-09 ] [ 1.138361934061024e-08 -1.858338867422325e-09 6.681002488176119e-09 ] [ 5.69406569520487e-09 5.345235956100405e-09 -6.333743202595362e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -20.539034 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.290716008861631e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.5564392 1.2886791 1.9132436 ] [ 2.4882699 0.3599523 4.0573683 ] [ 2.425721 2.660931 5.0376552 ] [ 1.4954872 3.5205345 2.8642206 ] [ 4.0539341 1.1940394 2.1989371 ] [ 4.64349 1.5367386 4.6253173 ] [ 3.9911437 3.4950839 3.17905 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5564392e-10 1.2886791e-10 1.9132436e-10 ] [ 2.4882699e-10 3.599523e-11 4.0573683e-10 ] [ 2.425721e-10 2.660931e-10 5.0376552e-10 ] [ 1.4954872e-10 3.5205345e-10 2.8642206e-10 ] [ 4.0539341e-10 1.1940394e-10 2.1989371e-10 ] [ 4.64349e-10 1.5367386e-10 4.6253173e-10 ] [ 3.9911437e-10 3.4950839e-10 3.179050000000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.64e-05 -1.19e-05 0.0001215 ] [ -2.5e-05 -3e-05 -3.56e-05 ] [ -0.0001313 9.8e-06 -2.05e-05 ] [ 2.98e-05 -4.23e-05 -3.55e-05 ] [ -7.46e-05 2.31e-05 -8.69e-05 ] [ 9.44e-05 -4.08e-05 6.19e-05 ] [ 9.03e-05 9.21e-05 -4.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.627569658112e-14 -1.906590178752e-14 1.946644594272e-13 ] [ -4.005441552e-14 -4.8065298624e-14 -5.703748770048e-14 ] [ -2.1036579031104e-13 1.570133088384e-14 -3.28446207264e-14 ] [ 4.774486329984001e-14 -6.777207105984e-14 -5.68772700384e-14 ] [ -1.1952237591168e-13 3.701027994048e-14 -1.3922914834752e-13 ] [ 1.5124547300352e-13 -6.536880612864e-14 9.917473282752e-14 ] [ 1.4467654885824e-13 1.4756046677568e-13 -7.53023011776e-15 ] ] } "relaxed-potential-energy" { "source-value" -25.011241 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.007242558739441e-18 } }