{ "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" [ [ 0.9701738 0.435353 0.8614305 ] [ 0.785215 2.880742 2.663197 ] [ 2.41347 1.4145 0.9828772 ] [ 2.657499 1.219941 2.828683 ] [ 1.63309 2.566255 0.271655 ] [ 2.657105 2.943765 2.654332 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.701738e-11 4.35353e-11 8.614305e-11 ] [ 7.85215e-11 2.880742e-10 2.663197e-10 ] [ 2.41347e-10 1.4145e-10 9.828772e-11 ] [ 2.657499e-10 1.219941e-10 2.828683e-10 ] [ 1.63309e-10 2.566255e-10 2.71655e-11 ] [ 2.657105e-10 2.943765e-10 2.654332e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -19.6966059 -12.0743987 -0.8398111 ] [ -14.4526879 -2.2619762 -2.2252083 ] [ 50.1261956 -27.4479214 12.8679842 ] [ -1.8297477 -31.2035713 16.409072 ] [ -30.7583169 41.8453614 -21.4029818 ] [ 16.6111628 31.1425063 -4.8090551 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.155744148209134e-08 -1.934531930735791e-08 -1.345525710308331e-09 ] [ -2.315575866109905e-08 -3.624085384446025e-09 -3.565176714670112e-09 ] [ 8.031101867996784e-08 -4.397641795663601e-08 2.061678344206379e-08 ] [ -2.931578986902572e-09 -4.999363242232586e-08 2.629023152742389e-08 ] [ -4.928025623233753e-08 6.704365972400677e-08 -3.42913570553679e-08 ] [ 2.661401668246267e-08 4.989579550697671e-08 -7.704955649359006e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 5.7785292 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 9.258224386850128e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.8665192 0.6796646 1.1511606 ] [ 0.5724156 2.538943 2.5847766 ] [ 3.133102 1.2812433 0.8359485 ] [ 2.285632 0.9667325 3.0226201 ] [ 1.4198842 2.8534521 0.3981025 ] [ 2.8389999 3.1405205 2.2695663 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.665192e-11 6.796646e-11 1.1511606e-10 ] [ 5.724156e-11 2.538943e-10 2.5847766e-10 ] [ 3.133102e-10 1.2812433e-10 8.359485e-11 ] [ 2.285632e-10 9.667325e-11 3.0226201e-10 ] [ 1.4198842e-10 2.8534521e-10 3.981025e-11 ] [ 2.8389999e-10 3.1405205e-10 2.2695663e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.89e-05 5e-06 -7.6e-06 ] [ 1.2e-06 -1.42e-05 -1.02e-05 ] [ 1.05e-05 2.18e-05 -5.5e-06 ] [ 5.8e-06 3.7e-06 2.69e-05 ] [ 2.09e-05 -3.9e-06 2.72e-05 ] [ -9.4e-06 -1.23e-05 -3.08e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.630290434112001e-14 8.010883104e-15 -1.217654231808e-14 ] [ 1.92261194496e-15 -2.275090801536e-14 -1.634220153216e-14 ] [ 1.68228545184e-14 3.492745033344e-14 -8.8119714144e-15 ] [ 9.292624400640001e-15 5.928053496960001e-15 4.309855109952001e-14 ] [ 3.348549137472e-14 -6.24848882112e-15 4.357920408576e-14 ] [ -1.506046023552e-14 -1.970677243584e-14 -4.934703992064001e-14 ] ] } "relaxed-potential-energy" { "source-value" -26.519951 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.248964547696158e-18 } }