{ "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" [ [ 1.051005 1.466214 2.567615 ] [ 0.3372835 2.721373 0.2523551 ] [ 2.822669 2.541764 0.4147021 ] [ 2.595922 2.673872 2.566842 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.051005e-10 1.466214e-10 2.567615e-10 ] [ 3.372835e-11 2.721373e-10 2.523551e-11 ] [ 2.822669e-10 2.541764e-10 4.147021e-11 ] [ 2.595922e-10 2.673872e-10 2.566842e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.9225786 -3.7211726 0.8845144 ] [ 0.2427197 -0.0175465 0.0157412 ] [ 0.5229911 0.4352682 -1.2748646 ] [ 4.1568678 3.3034509 0.374609 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.886840346970394e-09 -5.96197574168155e-09 1.41714829244094e-09 ] [ 3.888798287475898e-10 -2.81125920768672e-11 2.522018262333696e-11 ] [ 8.37924113306475e-10 6.973765338176985e-10 -2.042558256805544e-09 ] [ 6.66003640491633e-09 5.292711799940719e-09 6.001897817412672e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -4.0318431 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.459724753553796e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.3391569 1.4774289 3.4423373 ] [ 0.015624 2.6834165 0.068875 ] [ 3.7503775 2.8915921 0.8399255 ] [ 1.7017211 2.3507856 1.4503765 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3391569e-10 1.4774289e-10 3.4423373e-10 ] [ 1.5624e-12 2.6834165e-10 6.887500000000001e-12 ] [ 3.7503775e-10 2.8915921e-10 8.399255e-11 ] [ 1.7017211e-10 2.3507856e-10 1.4503765e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.7e-06 -6.3e-06 -2.28e-05 ] [ 1.26e-05 -2.21e-05 1.8e-05 ] [ -5.44e-05 -3.36e-05 2.31e-05 ] [ 3.72e-05 6.21e-05 -1.83e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.53023011776e-15 -1.009371271104e-14 -3.652962695424e-14 ] [ 2.018742542208e-14 -3.540810331968e-14 2.88391791744e-14 ] [ -8.715840817152e-14 -5.383313445888e-14 3.701027994048e-14 ] [ 5.960097029376001e-14 9.949516815168001e-14 -2.931983216064e-14 ] ] } "relaxed-potential-energy" { "source-value" -7.5090763 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.203086649166337e-18 } }