{ "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" [ [ 1.497272 0.041495 0.0459008 ] [ 0.5144624 2.623314 0.1336692 ] [ 0.1881884 1.665255 2.217108 ] [ 2.303156 0.3070008 2.474488 ] [ 2.009269 2.269424 0.9602388 ] [ 2.927445 2.103094 2.701001 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.497272e-10 4.1495e-12 4.59008e-12 ] [ 5.144624e-11 2.623314e-10 1.336692e-11 ] [ 1.881884e-11 1.665255e-10 2.217108e-10 ] [ 2.303156e-10 3.070008e-11 2.474488e-10 ] [ 2.009269e-10 2.269424e-10 9.602388e-11 ] [ 2.927445e-10 2.103094e-10 2.701001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.275622 -1.7971964 0.3169191 ] [ -22.5702899 8.694483 -14.4058606 ] [ -8.3913417 -2.8027312 4.8118682 ] [ -3.5512082 -15.6369381 0.9476004 ] [ 21.2588724 -0.2036372 -2.0491281 ] [ 11.9783455 11.7460198 10.3786009 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.043771745378138e-09 -2.879426055065925e-09 5.077603727049773e-10 ] [ -3.616159080245837e-08 1.393009739254305e-08 -2.308073305582386e-08 ] [ -1.344441148888413e-08 -4.490470403026729e-09 7.70946273241098e-09 ] [ -5.68966275363325e-09 -2.505313664471678e-08 1.518223206740728e-09 ] [ 3.406046834385039e-08 -3.262627609651738e-10 -3.283065134844324e-09 ] [ 1.919142511596489e-08 1.881919831101389e-08 1.662835171859384e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -0.36929276 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.916722263027054e-20 } "relaxed-configuration-positions" { "source-value" [ [ 2.3502679 -0.0396124 0.2918199 ] [ 0.1782959 2.9316352 0.6101813 ] [ -0.3974357 1.4076768 2.292479 ] [ 1.6397084 0.2574472 2.582963 ] [ 2.4398369 2.375394 0.2449516 ] [ 3.2291194 2.0770419 2.5100111 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3502679e-10 -3.96124e-12 2.918199e-11 ] [ 1.782959e-11 2.9316352e-10 6.101813e-11 ] [ -3.974357e-11 1.4076768e-10 2.292479e-10 ] [ 1.6397084e-10 2.574472e-11 2.582963e-10 ] [ 2.4398369e-10 2.375394e-10 2.449516e-11 ] [ 3.2291194e-10 2.0770419e-10 2.5100111e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.53e-05 -5e-07 6e-06 ] [ -8.6e-06 3.5e-06 2.3e-06 ] [ 4.9e-06 1.12e-05 -2e-07 ] [ -4.7e-06 -8.9e-06 -2.5e-06 ] [ -5.3e-06 -9e-07 -8e-07 ] [ -1.5e-06 -4.4e-06 -4.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.451330229824e-14 -8.010883104e-16 9.6130597248e-15 ] [ -1.377871893888e-14 5.6076181728e-15 3.68500622784e-15 ] [ 7.850665441919999e-15 1.794437815296e-14 -3.2043532416e-16 ] [ -7.53023011776e-15 -1.425937192512e-14 -4.005441552e-15 ] [ -8.491536090240001e-15 -1.44195895872e-15 -1.28174129664e-15 ] [ -2.4032649312e-15 -7.04957713152e-15 -7.69044777984e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.824992 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.375225558594703e-18 } }