{ "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" [ [ 0.0795215 1.172985 2.972487 ] [ 0.7048054 0.2310616 1.565444 ] [ 0.5328429 2.146868 1.561816 ] [ 2.937455 0.8293126 0.8336996 ] [ 1.506301 0.8690976 0.2004578 ] [ 2.979161 2.931887 0.4386378 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.95215e-12 1.172985e-10 2.972487e-10 ] [ 7.048054e-11 2.310616e-11 1.565444e-10 ] [ 5.328429e-11 2.146868e-10 1.561816e-10 ] [ 2.937455e-10 8.293126e-11 8.336996000000001e-11 ] [ 1.506301e-10 8.690976e-11 2.004578e-11 ] [ 2.979161e-10 2.931887e-10 4.386378e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -136.8686031 -45.309002 382.5426561 ] [ -55.8787922 -446.0555349 79.8073065 ] [ 62.6657506 357.2920523 -245.3212325 ] [ 911.1990642 -29.7247467 404.4255424 ] [ -785.4179505 153.6512967 -621.3393149 ] [ 4.3005311 10.1459347 -0.1149576 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.192876760083744e-07 -7.259302371618045e-08 6.129009000621545e-07 ] [ -8.952769446138141e-08 -7.146597495952184e-07 1.278654006433199e-07 ] [ 1.004016005362036e-07 5.72444972992711e-07 -3.930479432973412e-07 ] [ 1.459901837556078e-06 -4.762429422194195e-08 6.479611488876391e-07 ] [ -1.258378277847752e-06 2.461765153283442e-07 -9.954953239166691e-07 ] [ 6.890210385443306e-09 1.625557937250346e-08 -1.841823791032781e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 364.57627 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.841155762924685e-17 } "relaxed-configuration-positions" { "source-value" [ [ -0.045654 1.287952 3.1249209 ] [ 1.0938982 -0.5334108 1.7751923 ] [ 0.348561 3.0255134 1.3184939 ] [ 3.3974546 0.397376 0.9928816 ] [ 1.0769372 1.0825304 -0.3079741 ] [ 2.8688898 2.9212508 0.6690276 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.5654e-12 1.287952e-10 3.1249209e-10 ] [ 1.0938982e-10 -5.334108e-11 1.7751923e-10 ] [ 3.48561e-11 3.0255134e-10 1.3184939e-10 ] [ 3.3974546e-10 3.97376e-11 9.928816000000001e-11 ] [ 1.0769372e-10 1.0825304e-10 -3.079741e-11 ] [ 2.8688898e-10 2.9212508e-10 6.690276e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.23e-05 -2.12e-05 -4.93e-05 ] [ 2.67e-05 3.9e-06 1.91e-05 ] [ -2.7e-06 4.52e-05 3.48e-05 ] [ 2.48e-05 -3.14e-05 9.2e-06 ] [ -2.83e-05 -5e-06 1.02e-05 ] [ 1.9e-06 8.5e-06 -2.4e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.572853864384e-14 -3.396614436096001e-14 -7.898730740544e-14 ] [ 4.277811577536e-14 6.24848882112e-15 3.060157345728e-14 ] [ -4.32587687616e-15 7.241838326016e-14 5.575574640383999e-14 ] [ 3.973398019584e-14 -5.030834589312e-14 1.474002491136e-14 ] [ -4.534159836864e-14 -8.010883104e-15 1.634220153216e-14 ] [ 3.04413557952e-15 1.36185012768e-14 -3.84522388992e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.426274 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.27264986528549e-18 } }