{ "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" [ [ 2.55675 2.192965 3.527099 ] [ 1.806278 5.26626 2.450306 ] [ 0.8031725 3.384297 2.630387 ] [ 2.570894 3.149532 1.167105 ] [ 2.627788 4.286276 4.286712 ] [ 4.842075 2.861339 2.293967 ] [ 3.90768 5.002934 2.246314 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.55675e-10 2.192965e-10 3.527099e-10 ] [ 1.806278e-10 5.26626e-10 2.450306e-10 ] [ 8.031725e-11 3.384297e-10 2.630387e-10 ] [ 2.570894e-10 3.149532e-10 1.167105e-10 ] [ 2.627788e-10 4.286276e-10 4.286712e-10 ] [ 4.842075000000001e-10 2.861339e-10 2.293967e-10 ] [ 3.90768e-10 5.002934e-10 2.246314e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.8466441 -11.1053128 1.2775699 ] [ -10.9954321 16.9667124 -5.5098797 ] [ -14.9399992 -7.9888923 0.7229534 ] [ 3.3506251 -3.2051562 -8.3850951 ] [ 4.4274804 3.9282999 13.5654679 ] [ -0.2622892 -1.8731121 0.9590136 ] [ 14.5729711 3.2774611 -2.63003 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.163003245558257e-09 -1.779267253483099e-08 2.046892625217794e-09 ] [ -1.761662424621385e-08 2.718366993911746e-08 -8.827800438760518e-09 ] [ -2.39365174330107e-08 -1.279961646914914e-08 1.158299035407871e-09 ] [ 5.368293200285662e-09 -5.135226329652169e-09 -1.343440333240464e-08 ] [ 7.093605585930233e-09 6.293830259270978e-09 2.173427551959287e-08 ] [ -4.202336241283353e-10 -3.001056414757592e-09 1.536509168949243e-09 ] [ 2.334847359201406e-08 5.251071550001452e-09 -4.213772578002624e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.24369 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.121873049112275e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.8445759 2.0668201 3.9551153 ] [ 1.6682166 5.4365859 2.2038977 ] [ 0.9203309 3.0310888 2.6780377 ] [ 2.5696565 3.5419862 0.7313001 ] [ 2.5318848 4.5040836 4.4298888 ] [ 4.3988063 2.5481533 2.1205601 ] [ 4.1811665 5.014885 2.4830902 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8445759e-10 2.0668201e-10 3.9551153e-10 ] [ 1.6682166e-10 5.4365859e-10 2.2038977e-10 ] [ 9.203309e-11 3.0310888e-10 2.6780377e-10 ] [ 2.5696565e-10 3.5419862e-10 7.313001e-11 ] [ 2.5318848e-10 4.5040836e-10 4.4298888e-10 ] [ 4.398806300000001e-10 2.5481533e-10 2.1205601e-10 ] [ 4.1811665e-10 5.014884999999999e-10 2.4830902e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1e-07 -7.8e-06 -1.5e-06 ] [ 3.68e-05 -1.83e-05 -3e-07 ] [ 8.2e-06 1.71e-05 -1.02e-05 ] [ -2.36e-05 -1.87e-05 2e-07 ] [ 9.3e-06 -4.7e-06 -9.4e-06 ] [ -4.8e-06 1.39e-05 5.5e-06 ] [ -2.59e-05 1.83e-05 1.57e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.6021766208e-16 -1.249697764224e-14 -2.4032649312e-15 ] [ 5.896009964544001e-14 -2.931983216064e-14 -4.8065298624e-16 ] [ 1.313784829056e-14 2.739722021568e-14 -1.634220153216e-14 ] [ -3.781136825088e-14 -2.996070280896e-14 3.2043532416e-16 ] [ 1.490024257344e-14 -7.53023011776e-15 -1.506046023552e-14 ] [ -7.69044777984e-15 2.227025502912e-14 8.8119714144e-15 ] [ -4.149637447872e-14 2.931983216064e-14 2.515417294656e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.53667 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.450554916388474e-18 } }