{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.69276 0.7489354 1.12344 ] [ 2.32609 2.279725 3.013569 ] [ 2.388377 0.2175567 3.770382 ] [ 2.168931 2.205605 5.63033 ] [ 4.69019 0.7206414 2.589749 ] [ 3.957875 2.675588 1.380487 ] [ 4.50812 1.505291 4.661584 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.69276e-10 7.489354e-11 1.12344e-10 ] [ 2.32609e-10 2.279725e-10 3.013569e-10 ] [ 2.388377e-10 2.175567e-11 3.770382e-10 ] [ 2.168931e-10 2.205605e-10 5.63033e-10 ] [ 4.690190000000001e-10 7.206414e-11 2.589749e-10 ] [ 3.957875e-10 2.675588e-10 1.380487e-10 ] [ 4.50812e-10 1.505291e-10 4.661584000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -9.389539 -11.775465 -21.3868636 ] [ -27.9388562 25.5750439 1.4027195 ] [ -14.2847565 -19.8571629 7.8495742 ] [ -3.1093783 4.7007258 9.9509411 ] [ 30.6239592 -13.8466607 -2.8333557 ] [ 7.9111819 13.1478059 -7.7173908 ] [ 16.1873889 2.055713 12.7343753 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.504369986588981e-08 -1.886637472204867e-08 -3.426553285215853e-08 ] [ -4.476298221553313e-08 4.097573741251366e-08 2.247404388440266e-09 ] [ -2.288670289812084e-08 -3.181468215379713e-08 1.257640426647486e-08 ] [ -4.981773217482849e-09 7.531392977551376e-09 1.594316518537783e-08 ] [ 4.906499146657307e-08 -2.218479604969016e-08 -4.539536260950419e-09 ] [ 1.267511068307612e-08 2.10651072277963e-08 -1.236462311333701e-08 ] [ 2.593505604737743e-08 3.29361530767463e-09 2.040271838615299e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 10.608811 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.699718895868587e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4590898 0.2227146 1.3408015 ] [ 2.3510748 3.3957393 3.1572917 ] [ 1.6024174 -0.1668428 3.5135262 ] [ 2.3862533 1.673082 4.7760224 ] [ 5.5666093 1.6836448 2.8279866 ] [ 3.6569634 2.2509165 1.5532005 ] [ 4.709935 1.294088 5.000712 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4590898e-10 2.227146e-11 1.3408015e-10 ] [ 2.3510748e-10 3.3957393e-10 3.1572917e-10 ] [ 1.6024174e-10 -1.668428e-11 3.5135262e-10 ] [ 2.3862533e-10 1.673082e-10 4.776022399999999e-10 ] [ 5.5666093e-10 1.6836448e-10 2.8279866e-10 ] [ 3.6569634e-10 2.2509165e-10 1.5532005e-10 ] [ 4.709935e-10 1.294088e-10 5.000712e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.3e-06 -1e-06 1.21e-05 ] [ -1.38e-05 5.1e-06 -5e-07 ] [ 1.1e-06 -2.6e-06 -7.8e-06 ] [ 8.9e-06 5.1e-06 -1.13e-05 ] [ -1.97e-05 -2.7e-06 1.09e-05 ] [ 1.61e-05 -7e-07 8.5e-06 ] [ 1.17e-05 -3.1e-06 -1.19e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.889359469440001e-15 -1.6021766208e-15 1.938633711168e-14 ] [ -2.211003736704e-14 8.17110076608e-15 -8.010883104e-16 ] [ 1.76239428288e-15 -4.16565921408e-15 -1.249697764224e-14 ] [ 1.425937192512e-14 8.17110076608e-15 -1.810459581504e-14 ] [ -3.156287942976e-14 -4.32587687616e-15 1.746372516672e-14 ] [ 2.579504359488e-14 -1.12152363456e-15 1.36185012768e-14 ] [ 1.874546646336e-14 -4.96674752448e-15 -1.906590178752e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.037353 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.889902527771674e-18 } }