{ "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" [ [ 0.6660422 0.1321237 2.521111 ] [ 1.154832 2.450071 0.6217319 ] [ 0.2052378 1.707228 1.69737 ] [ 2.767871 1.123615 2.427941 ] [ 1.781428 1.004966 1.555643 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.660422e-11 1.321237e-11 2.521111e-10 ] [ 1.154832e-10 2.450071e-10 6.217319e-11 ] [ 2.052378e-11 1.707228e-10 1.69737e-10 ] [ 2.767871e-10 1.123615e-10 2.427941e-10 ] [ 1.781428e-10 1.004966e-10 1.555643e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -11.9952513 -21.6801637 16.6280789 ] [ 7.3113198 20.343091 -20.66961 ] [ -35.0207193 9.9556224 9.6660528 ] [ 23.3169054 3.5131293 18.0421172 ] [ 16.3877454 -12.131679 -23.6666388 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.921851119348081e-08 -3.473545141525682e-08 2.664111926239778e-08 ] [ 1.171402565075213e-08 3.25932247950069e-08 -3.311636590305388e-08 ] [ -5.610937770605934e-08 1.595066545479279e-08 1.548672381157838e-08 ] [ 3.735780070128528e-08 5.62865363030747e-09 2.890665836757356e-08 ] [ 2.625606254750275e-08 -1.943709246485032e-08 -3.791813537827817e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 27.4730212245911 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.401663230878205e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.8961143 -0.1596857 2.8120921 ] [ 1.7340488 2.7268882 0.7174271 ] [ -0.042254 1.7820127 1.9086221 ] [ 2.3387039 1.6779812 2.7177216 ] [ 1.6487979 0.3908074 0.667934 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.961143000000001e-11 -1.596857e-11 2.8120921e-10 ] [ 1.7340488e-10 2.7268882e-10 7.174271e-11 ] [ -4.2254e-12 1.7820127e-10 1.9086221e-10 ] [ 2.3387039e-10 1.6779812e-10 2.7177216e-10 ] [ 1.6487979e-10 3.908074e-11 6.679340000000001e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.3e-06 -2.43e-05 1.83e-05 ] [ 9.5e-06 1.96e-05 -1.36e-05 ] [ 2e-06 1.8e-06 5e-07 ] [ -8.2e-06 -1.1e-06 -7.7e-06 ] [ 1e-07 4e-06 2.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.28718284864e-15 -3.893289188544e-14 2.931983216064e-14 ] [ 1.52206778976e-14 3.140266176767999e-14 -2.178960204288e-14 ] [ 3.2043532416e-15 2.88391791744e-15 8.010883104e-16 ] [ -1.313784829056e-14 -1.76239428288e-15 -1.233675998016e-14 ] [ 1.6021766208e-16 6.4087064832e-15 4.005441552e-15 ] ] } "relaxed-potential-energy" { "source-value" -5.7659997754089005 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.238150035698192e-19 } }