{ "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" [ [ 0.19695 0.77855 2.710152 ] [ 1.11009 0.0001542 2.008775 ] [ 0.4144899 1.96716 0.2031325 ] [ 1.283205 2.99395 1.505794 ] [ 2.698669 0.3602939 2.825256 ] [ 2.163799 2.696333 2.742799 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9695e-11 7.7855e-11 2.710152e-10 ] [ 1.11009e-10 1.542e-14 2.008775e-10 ] [ 4.144899e-11 1.96716e-10 2.031325e-11 ] [ 1.283205e-10 2.99395e-10 1.505794e-10 ] [ 2.698669e-10 3.602939e-11 2.825256e-10 ] [ 2.163799e-10 2.696333e-10 2.742799e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -41.9874709 40.5309821 31.7026325 ] [ 31.644621 -36.4091651 -41.4791972 ] [ -3.8851318 -10.5406868 -3.7606015 ] [ -16.3516123 15.1474853 -20.5379751 ] [ 11.7269194 3.7928773 5.9584586 ] [ 18.8526745 -12.5214928 28.1166828 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.727134424250033e-08 6.49377919386833e-08 5.079321660931426e-08 ] [ 5.070027194027672e-08 -5.833391310606731e-08 -6.645700000339283e-08 ] [ -6.224667338686621e-09 -1.688804195813516e-08 -6.025147803445411e-09 ] [ -2.619817093944571e-08 2.426894681157167e-08 -3.290546354379254e-08 ] [ 1.878859609668596e-08 6.076859335623027e-09 9.5465030649247e-09 ] [ 3.020531432345233e-08 -2.006164302167553e-08 4.504789183660948e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 12.029699 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.927370249306114e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.4703036 1.3754225 2.6664949 ] [ 1.2255399 -0.4493512 1.2832131 ] [ 0.2153863 1.4687973 0.2706767 ] [ 0.9520286 3.4082445 1.4626614 ] [ 2.5864751 0.3045979 3.1009973 ] [ 2.4174693 2.6887301 3.211865 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.703036e-11 1.3754225e-10 2.6664949e-10 ] [ 1.2255399e-10 -4.493512e-11 1.2832131e-10 ] [ 2.153863e-11 1.4687973e-10 2.706767e-11 ] [ 9.520286e-11 3.4082445e-10 1.4626614e-10 ] [ 2.5864751e-10 3.045979e-11 3.1009973e-10 ] [ 2.4174693e-10 2.6887301e-10 3.211865e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.4e-06 4.4e-06 1.34e-05 ] [ -1.87e-05 -1.63e-05 -1.41e-05 ] [ 4e-07 -1.41e-05 -4.5e-06 ] [ 1.68e-05 7.8e-06 -2.5e-06 ] [ 1.25e-05 3.93e-05 -9.3e-06 ] [ -1.35e-05 -2.11e-05 1.7e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.84522388992e-15 7.04957713152e-15 2.146916671872e-14 ] [ -2.996070280896e-14 -2.611547891904e-14 -2.259069035328e-14 ] [ 6.408706483200001e-16 -2.259069035328e-14 -7.2097947936e-15 ] [ 2.691656722944e-14 1.249697764224e-14 -4.005441552e-15 ] [ 2.002720776e-14 6.296554119743999e-14 -1.490024257344e-14 ] [ -2.16293843808e-14 -3.380592669888e-14 2.72370025536e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.130796 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.385526733009416e-18 } }