{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.38521 1.90546 0.8111876 ] [ 1.820048 1.934055 3.373724 ] [ 3.762919 1.896883 2.504871 ] [ 3.3319 2.668439 4.803022 ] [ 3.103403 4.016922 2.717172 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.38521e-10 1.90546e-10 8.111876000000001e-11 ] [ 1.820048e-10 1.934055e-10 3.373724e-10 ] [ 3.762919e-10 1.896883e-10 2.504871e-10 ] [ 3.3319e-10 2.668439e-10 4.803022000000001e-10 ] [ 3.103403e-10 4.016922e-10 2.717172e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.8860416 -0.8707031 -11.1494346 ] [ -19.7852019 -4.6159792 2.5472876 ] [ 23.8168453 -12.15648 -7.1356918 ] [ 4.2648547 4.2624389 17.2514847 ] [ -1.4104565 13.3807234 -1.5136459 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.103265486137623e-08 -1.395020150478084e-09 -1.78633634512586e-08 ] [ -3.169938792198775e-08 -7.395613956339088e-09 4.081204639173742e-09 ] [ 3.815879272087037e-08 -1.947682804722279e-08 -1.143263857519427e-08 ] [ 6.833050491448998e-09 6.82917995316847e-09 2.76399254604289e-08 ] [ -2.259800428955395e-09 2.143828220087149e-08 -2.425128073149774e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.4141418 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.67441141365603e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.249715 1.0585086 1.0022071 ] [ 1.4368082 2.4348556 3.0102365 ] [ 4.1787489 2.2043316 2.2485085 ] [ 3.4023544 2.2497982 4.7907578 ] [ 3.1358535 4.4742651 3.1582667 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.249715e-10 1.0585086e-10 1.0022071e-10 ] [ 1.4368082e-10 2.4348556e-10 3.0102365e-10 ] [ 4.1787489e-10 2.2043316e-10 2.2485085e-10 ] [ 3.4023544e-10 2.2497982e-10 4.7907578e-10 ] [ 3.1358535e-10 4.4742651e-10 3.1582667e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.06e-05 -1.4e-06 -2.16e-05 ] [ -6.3e-06 1.98e-05 5.03e-05 ] [ -5.9e-06 3.17e-05 5.47e-05 ] [ -1.6e-06 -2.57e-05 -3.69e-05 ] [ 3.3e-06 -2.43e-05 -4.64e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.698307218048e-14 -2.24304726912e-15 -3.460701500928e-14 ] [ -1.009371271104e-14 3.172309709184e-14 8.058948402624e-14 ] [ -9.45284206272e-15 5.078899887936e-14 8.763906115775999e-14 ] [ -2.56348259328e-15 -4.117593915456e-14 -5.912031730752001e-14 ] [ 5.28718284864e-15 -3.893289188544e-14 -7.434099520512001e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.801245 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.53163853185329e-18 } }