{ "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" [ [ 1.797173 1.880519 2.621604 ] [ 2.732492 2.231734 4.550403 ] [ 1.229923 3.945183 3.396256 ] [ 3.798537 2.960677 2.455754 ] [ 3.373455 4.934702 3.584472 ] [ 4.913806 3.358248 4.34106 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.797173e-10 1.880519e-10 2.621604e-10 ] [ 2.732492e-10 2.231734e-10 4.550403000000001e-10 ] [ 1.229923e-10 3.945183e-10 3.396256e-10 ] [ 3.798537e-10 2.960677e-10 2.455754e-10 ] [ 3.373455e-10 4.934702e-10 3.584472e-10 ] [ 4.913806e-10 3.358248e-10 4.34106e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.6871809 -1.8072035 -2.6464467 ] [ -0.3564526 -7.6186663 11.1118768 ] [ -4.6891561 4.5402308 -0.7250482 ] [ 3.5409353 -2.2220041 -13.072418 ] [ -1.9992892 8.0634818 -0.5413516 ] [ 5.1911434 -0.9558386 5.8733877 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.703161793040303e-09 -2.895459196727933e-09 -4.240075030933311e-09 ] [ -5.711000221433741e-10 -1.220644902753684e-08 1.780318922216992e-08 ] [ -7.512856274701706e-09 7.274251640796081e-09 -1.161655274993123e-09 ] [ 5.673203753425435e-09 -3.560043020341745e-09 -2.09443224969251e-08 ] [ -3.203214414457935e-09 1.29191220222063e-08 -8.673408771526734e-10 ] [ 8.317128590700222e-09 -1.531422258178203e-09 9.410204457834285e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.9719202 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.117024754652326e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9531379 1.9497547 2.6203062 ] [ 2.6836604 1.8729372 5.0204847 ] [ 1.1197096 4.1015087 3.6081057 ] [ 4.0958138 3.0066006 1.9152708 ] [ 3.3490742 5.1127332 3.3079905 ] [ 4.6439901 3.2675287 4.4773911 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9531379e-10 1.9497547e-10 2.6203062e-10 ] [ 2.6836604e-10 1.8729372e-10 5.0204847e-10 ] [ 1.1197096e-10 4.1015087e-10 3.6081057e-10 ] [ 4.0958138e-10 3.0066006e-10 1.9152708e-10 ] [ 3.3490742e-10 5.1127332e-10 3.3079905e-10 ] [ 4.6439901e-10 3.267528700000001e-10 4.4773911e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.7e-06 -6.7e-06 -4e-06 ] [ 2.68e-05 -7.4e-06 -1.8e-06 ] [ 3e-06 1.87e-05 -6.7e-06 ] [ -1.72e-05 1.17e-05 1.88e-05 ] [ 3.7e-06 -8.7e-06 -1.35e-05 ] [ -2.01e-05 -7.6e-06 7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.928053496960001e-15 -1.073458335936e-14 -6.4087064832e-15 ] [ 4.293833343744e-14 -1.185610699392e-14 -2.88391791744e-15 ] [ 4.8065298624e-15 2.996070280896e-14 -1.073458335936e-14 ] [ -2.755743787776e-14 1.874546646336e-14 3.012092047104e-14 ] [ 5.928053496960001e-15 -1.393893660096e-14 -2.16293843808e-14 ] [ -3.220375007808e-14 -1.217654231808e-14 1.12152363456e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.32232 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.294688625961625e-18 } }