{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.290406 1.365127 2.478138 ] [ 1.892594 2.812526 4.141756 ] [ 2.634032 3.625436 1.937955 ] [ 4.696761 2.293416 2.137678 ] [ 4.185297 2.165547 4.431715 ] [ 4.453239 5.273552 2.545611 ] [ 3.870361 4.380343 4.592008 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.290406e-10 1.365127e-10 2.478138e-10 ] [ 1.892594e-10 2.812526e-10 4.141756e-10 ] [ 2.634032e-10 3.625436e-10 1.937955e-10 ] [ 4.696761000000001e-10 2.293416e-10 2.137678e-10 ] [ 4.185297000000001e-10 2.165547e-10 4.431715e-10 ] [ 4.453239e-10 5.273551999999999e-10 2.545611e-10 ] [ 3.870361e-10 4.380343e-10 4.592008e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.8526274 -0.4148812 -0.548233 ] [ 0.3885271 0.8888593 0.4910523 ] [ 0.2430407 0.8675154 -0.6564276 ] [ -0.9136299 0.6476995 0.063194 ] [ 0.4404133 -1.1682129 0.4193182 ] [ -0.5497785 -1.5708797 -0.3711597 ] [ -0.4612 0.7498997 0.6022558 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.36605968653349e-09 -6.64712959049449e-10 -8.783660953510464e-10 ] [ 6.224890361672237e-10 1.424109589640654e-09 7.867525146500678e-10 ] [ 3.893941274428666e-10 1.38991289206396e-09 -1.051712953967854e-09 ] [ -1.463796465843842e-09 1.03772899620385e-09 1.012479493748352e-10 ] [ 7.056198927493766e-10 -1.871683396496968e-09 6.718218167159386e-10 ] [ -8.808422593184928e-10 -2.516826729429318e-09 -5.946633939231417e-10 ] [ -7.3892385751296e-10 1.201471767284934e-09 9.649201625012007e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -20.198838 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.236210601092663e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6327815 1.4123119 2.6132464 ] [ 1.9169375 3.1313469 4.0996514 ] [ 2.4563833 3.642252 1.7927678 ] [ 4.6657251 2.5260555 2.0622021 ] [ 4.1262774 2.0151562 4.3690889 ] [ 4.3750758 4.8432896 2.5401877 ] [ 3.8495095 4.3455348 4.7877166 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6327815e-10 1.4123119e-10 2.6132464e-10 ] [ 1.9169375e-10 3.1313469e-10 4.0996514e-10 ] [ 2.4563833e-10 3.642252e-10 1.7927678e-10 ] [ 4.665725100000001e-10 2.5260555e-10 2.0622021e-10 ] [ 4.1262774e-10 2.0151562e-10 4.369088900000001e-10 ] [ 4.3750758e-10 4.8432896e-10 2.5401877e-10 ] [ 3.8495095e-10 4.345534800000001e-10 4.7877166e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.55e-05 7e-06 -4.5e-06 ] [ -1.55e-05 1.61e-05 2.43e-05 ] [ 2e-07 -1.2e-06 -8.1e-06 ] [ -1e-06 9.1e-06 5e-06 ] [ 5.8e-06 -4.8e-06 5e-07 ] [ 4.9e-06 -7.6e-06 -1.57e-05 ] [ -9.8e-06 -1.87e-05 -1.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.48337376224e-14 1.12152363456e-14 -7.2097947936e-15 ] [ -2.48337376224e-14 2.579504359488e-14 3.893289188544e-14 ] [ 3.2043532416e-16 -1.92261194496e-15 -1.297763062848e-14 ] [ -1.6021766208e-15 1.457980724928e-14 8.010883104e-15 ] [ 9.292624400640001e-15 -7.69044777984e-15 8.010883104e-16 ] [ 7.850665441919999e-15 -1.217654231808e-14 -2.515417294656e-14 ] [ -1.570133088384e-14 -2.996070280896e-14 -2.4032649312e-15 ] ] } "relaxed-potential-energy" { "source-value" -21.43874 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.434864800740979e-18 } }