{ "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" [ [ 2.875077 1.739271 0.5500127 ] [ 2.247142 4.095662 1.890424 ] [ 4.370849 2.938246 1.693427 ] [ 3.902852 1.049683 3.036341 ] [ 5.923496 0.662055 4.457524 ] [ 5.031061 2.817229 4.209838 ] [ 4.680107 5.055758 2.976326 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.875077e-10 1.739271e-10 5.500127000000001e-11 ] [ 2.247142e-10 4.095662e-10 1.890424e-10 ] [ 4.370849e-10 2.938246e-10 1.693427e-10 ] [ 3.902852e-10 1.049683e-10 3.036341e-10 ] [ 5.923496e-10 6.62055e-11 4.457524e-10 ] [ 5.031061e-10 2.817229e-10 4.209838000000001e-10 ] [ 4.680106999999999e-10 5.055758e-10 2.976326e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.5451202 -5.1025019 -9.3327406 ] [ -6.7716637 5.1881363 0.6979149 ] [ 7.0367376 2.0349317 -11.0554377 ] [ -6.052692 -11.1580508 2.3175477 ] [ 5.6851064 -4.9696096 2.6241085 ] [ 3.8321607 6.3543005 12.9257731 ] [ 1.8154712 7.6527939 1.8228341 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.88426194396582e-09 -8.175109251767579e-09 -1.495269879731096e-08 ] [ -1.084940126406003e-08 8.312310685383815e-09 1.11818293608797e-09 ] [ 1.12740964694243e-08 3.260319994664799e-09 -1.771276381565093e-08 ] [ -9.697481615303194e-09 -1.787716812545874e-08 3.713120742528812e-09 ] [ 9.108544560840452e-09 -7.96219231562324e-09 4.204285289142557e-09 ] [ 6.139798280688564e-09 1.018071170263775e-08 2.070937146658554e-08 ] [ 2.908705512375721e-09 1.226112747038085e-08 2.920502178617009e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -0.56539196 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.058577799002889e-20 } "relaxed-configuration-positions" { "source-value" [ [ 2.2659754 2.4854544 0.7613047 ] [ 2.2522584 4.4710438 2.1767672 ] [ 4.6558761 2.2172176 1.163667 ] [ 5.0108191 0.3636401 2.5660807 ] [ 5.2141422 1.1384824 4.7799087 ] [ 4.9893282 3.4820126 4.7890215 ] [ 4.6421845 4.2000531 2.5771427 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2659754e-10 2.4854544e-10 7.613047e-11 ] [ 2.2522584e-10 4.471043800000001e-10 2.1767672e-10 ] [ 4.6558761e-10 2.2172176e-10 1.163667e-10 ] [ 5.0108191e-10 3.636401000000001e-11 2.5660807e-10 ] [ 5.2141422e-10 1.1384824e-10 4.7799087e-10 ] [ 4.9893282e-10 3.4820126e-10 4.789021499999999e-10 ] [ 4.6421845e-10 4.2000531e-10 2.5771427e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.44e-05 1e-06 -2.4e-06 ] [ -6e-07 1.04e-05 1.9e-06 ] [ 5.5e-06 -1.92e-05 -4.7e-06 ] [ 8.9e-06 -6.6e-06 -1.24e-05 ] [ 5.3e-06 1.3e-06 9.3e-06 ] [ -1.26e-05 3.9e-06 8e-07 ] [ 7.9e-06 9.3e-06 7.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.307134333952e-14 1.6021766208e-15 -3.84522388992e-15 ] [ -9.6130597248e-16 1.666263685632e-14 3.04413557952e-15 ] [ 8.8119714144e-15 -3.076179111936e-14 -7.53023011776e-15 ] [ 1.425937192512e-14 -1.057436569728e-14 -1.986699009792e-14 ] [ 8.491536090240001e-15 2.08282960704e-15 1.490024257344e-14 ] [ -2.018742542208e-14 6.24848882112e-15 1.28174129664e-15 ] [ 1.265719530432e-14 1.490024257344e-14 1.233675998016e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.355219 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.780612613066396e-18 } }