{ "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" [ [ 1.097689 0.3905239 0.41263 ] [ 0.032965 0.0756626 2.808384 ] [ 2.827906 0.6568563 1.349893 ] [ 2.515385 2.187975 0.7174512 ] [ 1.727021 2.867394 2.060494 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.097689e-10 3.905239e-11 4.1263e-11 ] [ 3.2965e-12 7.56626e-12 2.808384e-10 ] [ 2.827906e-10 6.568562999999999e-11 1.349893e-10 ] [ 2.515385e-10 2.187975e-10 7.174512e-11 ] [ 1.727021e-10 2.867394e-10 2.060494e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -65.9433058 -21.3415459 -27.3558753 ] [ 1.2228483 0.4165378 -3.8328287 ] [ 140.0506339 -418.967972 210.9103749 ] [ 137.1389771 260.8787085 -545.4593346 ] [ -212.4691535 179.0142715 365.7376637 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.056528237214767e-07 -3.419292617441849e-08 -4.382894420827774e-08 ] [ 1.959218973186622e-09 6.673671303377652e-10 -6.140868585264595e-09 ] [ 2.243858532114683e-07 -6.712606951327661e-07 3.3791567453296e-07 ] [ 2.197208647202811e-07 4.179737710667972e-07 -8.739222006933078e-07 ] [ -3.404131131834593e-07 2.868124829498321e-07 5.859763389538899e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 174.25291 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.791839408085049e-17 } "relaxed-configuration-positions" { "source-value" [ [ 1.1029564 0.0338189 0.5631279 ] [ -0.1917186 0.8483397 2.5895727 ] [ 3.680316 6.46e-05 0.9467341 ] [ 2.4821127 2.2899798 0.6125824 ] [ 1.1272995 3.0062088 2.6368351 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1029564e-10 3.38189e-12 5.631279000000001e-11 ] [ -1.917186e-11 8.483397000000001e-11 2.5895727e-10 ] [ 3.680316e-10 6.46e-15 9.467341000000001e-11 ] [ 2.4821127e-10 2.2899798e-10 6.125824e-11 ] [ 1.1272995e-10 3.0062088e-10 2.6368351e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.93e-05 1.68e-05 2.9e-06 ] [ 5e-07 -2.5e-05 -1.79e-05 ] [ 4.03e-05 -4.27e-05 2.18e-05 ] [ -4.59e-05 3.28e-05 -1.06e-05 ] [ 2.44e-05 1.81e-05 3.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.09220090362e-14 2.691656745119999e-14 4.6463122386e-15 ] [ 8.010883169999999e-16 -4.005441585e-14 -2.86789617486e-14 ] [ 6.456771835019998e-14 -6.84129422718e-14 3.492745062119999e-14 ] [ -7.353990750059999e-14 5.255139359519999e-14 -1.69830723204e-14 ] [ 3.909310986959999e-14 2.899939707539999e-14 6.088271209199999e-15 ] ] } "relaxed-potential-energy" { "source-value" -16.178089 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.592015617857242e-18 } }