{ "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" [ [ 2.000595 3.042383 1.797674 ] [ 1.826337 5.433854 1.209578 ] [ 3.662908 4.706413 0.0276768 ] [ 4.382961 3.15094 1.702274 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.000595e-10 3.042383e-10 1.797674e-10 ] [ 1.826337e-10 5.433854e-10 1.209578e-10 ] [ 3.662908e-10 4.706413e-10 2.76768e-12 ] [ 4.382961e-10 3.15094e-10 1.702274e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 4.4614453 4.9879536 -2.2295726 ] [ 2.8725006 -5.0150502 -0.319291 ] [ -2.0628716 -2.675002 5.087311 ] [ -5.2710743 2.7020986 -2.5384474 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.148023354638043e-09 7.991582643555196e-09 -3.57216909409627e-09 ] [ 4.602253304553972e-09 -8.034996182578365e-09 -5.115605754318528e-10 ] [ -3.305084649232289e-09 -4.285825664993242e-09 8.150770746938668e-09 ] [ -8.445192009959727e-09 4.329239204016411e-09 -4.067041077410546e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.514481 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.005040887964581e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.070706 3.0637084 1.2381352 ] [ 2.3907932 5.2206157 1.6549324 ] [ 3.3609405 4.2739068 -0.1031852 ] [ 4.0503614 3.7753591 1.9473203 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.070706e-10 3.0637084e-10 1.2381352e-10 ] [ 2.3907932e-10 5.2206157e-10 1.6549324e-10 ] [ 3.3609405e-10 4.2739068e-10 -1.031852e-11 ] [ 4.0503614e-10 3.775359100000001e-10 1.9473203e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.74e-05 2.37e-05 -1.5e-06 ] [ -1.48e-05 4.1e-06 2.49e-05 ] [ 4.6e-06 -2.2e-05 -2.01e-05 ] [ -1.72e-05 -5.8e-06 -3.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.389963940992e-14 3.797158591296e-14 -2.4032649312e-15 ] [ -2.371221398784e-14 6.568924145279999e-15 3.989419785791999e-14 ] [ 7.370012455680001e-15 -3.52478856576e-14 -3.220375007808e-14 ] [ -2.755743787776e-14 -9.292624400640001e-15 -5.28718284864e-15 ] ] } "relaxed-potential-energy" { "source-value" -19.027265 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.048503914076612e-18 } }