{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.060429 2.678734 2.453953 ] [ 2.544795 1.257014 4.108114 ] [ 3.849483 1.551428 2.063601 ] [ 4.178567 2.654376 4.014408 ] [ 4.257126 3.923601 2.295059 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.060429e-10 2.678734e-10 2.453953e-10 ] [ 2.544795e-10 1.257014e-10 4.108114e-10 ] [ 3.849483e-10 1.551428e-10 2.063601e-10 ] [ 4.178567e-10 2.654376e-10 4.014408000000001e-10 ] [ 4.257126000000001e-10 3.923601e-10 2.295059e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -15.6658849 4.8491213 -6.5304314 ] [ -11.0584161 -10.6114369 17.1535091 ] [ 9.6178892 -15.5780022 -21.1832653 ] [ 10.0028788 4.9585005 14.9509664 ] [ 7.1035331 16.3818174 -4.3907789 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.509951453092375e-08 7.769148778283304e-09 -1.046290451281821e-08 ] [ -1.771753573849832e-08 -1.700139611427442e-08 2.748295124470005e-08 ] [ 1.540955721768482e-08 -2.495871092361097e-08 -3.39393324158639e-08 ] [ 1.602637855405596e-08 7.944393575325111e-09 2.395408882444634e-08 ] [ 1.138111465789895e-08 2.624656484449464e-08 -7.034803300681941e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.9017357 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.426215282308072e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0606498 2.9888004 2.6733587 ] [ 2.4552333 0.8731922 4.0365246 ] [ 3.9862879 1.4287732 2.0777196 ] [ 4.0873012 2.8215165 4.2100002 ] [ 4.3009279 3.9528708 1.937532 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0606498e-10 2.9888004e-10 2.6733587e-10 ] [ 2.4552333e-10 8.731922e-11 4.0365246e-10 ] [ 3.9862879e-10 1.4287732e-10 2.0777196e-10 ] [ 4.0873012e-10 2.8215165e-10 4.2100002e-10 ] [ 4.3009279e-10 3.9528708e-10 1.937532e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.15e-05 3.1e-06 1.6e-05 ] [ -4.2e-06 6.1e-06 -1.25e-05 ] [ 2.9e-06 3.43e-05 4.6e-06 ] [ -1.88e-05 1.59e-05 -3.96e-05 ] [ -4.13e-05 -5.94e-05 3.14e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.853386217920001e-14 4.96674752448e-15 2.56348259328e-14 ] [ -6.72914180736e-15 9.77327738688e-15 -2.002720776e-14 ] [ 4.646312200320001e-15 5.495465809344e-14 7.370012455680001e-15 ] [ -3.012092047104e-14 2.547460827072e-14 -6.344619418368e-14 ] [ -6.616989443904001e-14 -9.516929127552e-14 5.030834589312e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.756113 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.844842912488295e-18 } }