{ "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" [ [ 0.2934362 2.840867 1.110891 ] [ 0.7634727 2.370483 2.358735 ] [ 2.954483 0.5132865 0.5514058 ] [ 1.977096 2.170821 0.0967804 ] [ 2.774594 2.595093 2.624283 ] [ 2.05175 1.547661 1.964386 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.934362e-11 2.840867e-10 1.110891e-10 ] [ 7.634727e-11 2.370483e-10 2.358735e-10 ] [ 2.954483e-10 5.132865e-11 5.514058e-11 ] [ 1.977096e-10 2.170821e-10 9.67804e-12 ] [ 2.774594e-10 2.595093e-10 2.624283e-10 ] [ 2.05175e-10 1.547661e-10 1.964386e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -42.8826923 29.2718176 -71.2464374 ] [ -23.1175926 -2.6487039 78.1751372 ] [ 10.2594166 -18.7119852 -10.4676734 ] [ 0.7848785 9.9862845 -18.1999512 ] [ 57.7450109 57.5191849 45.8685458 ] [ -2.7890211 -75.4165979 -24.129621 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.870564760607171e-08 4.689862219342995e-08 -1.141493772580237e-07 ] [ -3.70384666980513e-08 -4.243691498964673e-09 1.252503781815842e-07 ] [ 1.643739755499172e-08 -2.997990546319381e-08 -1.677106173382333e-08 ] [ 1.257513993228969e-09 1.599979168637637e-08 -2.915953655258026e-08 ] [ 9.251770719405529e-08 9.215589405350561e-08 7.348951231631882e-08 ] [ -4.468504438152976e-09 -1.208307109711535e-07 -3.865991495347572e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 45.526569 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.294160507798874e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.455543 3.4467577 0.5147195 ] [ 0.682486 2.7515999 2.7001128 ] [ 3.49135 1.0550684 0.1687159 ] [ 1.1839152 1.3651695 -0.1539483 ] [ 2.9251829 2.620468 3.3912461 ] [ 2.0763549 0.799148 2.0856352 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.55543e-11 3.4467577e-10 5.147195e-11 ] [ 6.82486e-11 2.7515999e-10 2.7001128e-10 ] [ 3.49135e-10 1.0550684e-10 1.687159e-11 ] [ 1.1839152e-10 1.3651695e-10 -1.539483e-11 ] [ 2.9251829e-10 2.620468e-10 3.3912461e-10 ] [ 2.0763549e-10 7.99148e-11 2.0856352e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.86e-05 4.15e-05 4.11e-05 ] [ -2e-05 3.81e-05 -1.87e-05 ] [ 6.59e-05 -2.02e-05 -2.71e-05 ] [ 1.47e-05 -2.62e-05 -5e-07 ] [ -5.6e-06 -3.23e-05 -2.83e-05 ] [ -6.4e-06 -9e-07 3.35e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.786578441239999e-14 6.649033031099999e-14 6.58494596574e-14 ] [ -3.204353268e-14 6.10429297554e-14 -2.99607030558e-14 ] [ 1.055834401806e-13 -3.236396800679999e-14 -4.34189867814e-14 ] [ 2.35519965198e-14 -4.197702781079999e-14 -8.010883169999999e-16 ] [ -8.972189150399999e-15 -5.17503052782e-14 -4.53415987422e-14 ] [ -1.02539304576e-14 -1.4419589706e-15 5.367291723899999e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.269205 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.766831673875597e-18 } }