{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.600247 1.761403 2.21582 ] [ 1.350999 3.710266 1.758192 ] [ 4.508932 5.134782 2.974852 ] [ 3.702352 3.46043 0.9070332 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.600247e-10 1.761403e-10 2.21582e-10 ] [ 1.350999e-10 3.710266e-10 1.758192e-10 ] [ 4.508932e-10 5.134782e-10 2.974852e-10 ] [ 3.702352e-10 3.46043e-10 9.070332e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.2230417 0.3746875 -0.2803207 ] [ -0.5112417 0.0398645 0.1923049 ] [ 0.0 0.0 0.0 ] [ 0.2882 -0.414552 0.0880158 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.573522001476378e-10 6.003155575518749e-10 -4.491232755665237e-10 ] [ -8.190995060664377e-10 6.386997042609299e-11 3.081064173837066e-10 ] [ 0.0 0.0 0.0 ] [ 4.617473059188e-10 -6.64185527977968e-10 1.410168581828172e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -4.2372408 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.788808202391467e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.5833765 2.3596401 1.9231216 ] [ 0.6140472 3.5138532 2.1625851 ] [ 4.508932 5.134782 2.974852 ] [ 4.4561744 3.0586057 0.7953385 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5833765e-10 2.3596401e-10 1.9231216e-10 ] [ 6.140472e-11 3.5138532e-10 2.1625851e-10 ] [ 4.508932e-10 5.134782e-10 2.974852e-10 ] [ 4.4561744e-10 3.0586057e-10 7.953385e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.21e-05 8.2e-06 -1.33e-05 ] [ -2.28e-05 2.7e-06 8.1e-06 ] [ 0.0 0.0 0.0 ] [ 7e-07 -1.09e-05 5.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.54081036114e-14 1.31378483988e-14 -2.13089492322e-14 ] [ -3.65296272552e-14 4.3258769118e-15 1.29776307354e-14 ] [ 0.0 0.0 0.0 ] [ 1.1215236438e-15 -1.74637253106e-14 8.331318496799998e-15 ] ] } "relaxed-potential-energy" { "source-value" -5.3319193 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.542676516833636e-19 } }