{ "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" [ [ 0.3527209 0.4565602 1.167471 ] [ 0.6414148 2.926013 0.4472085 ] [ 0.2560781 2.125953 2.651252 ] [ 2.793307 0.1807352 2.367537 ] [ 2.546309 2.149048 0.8335699 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.527209e-11 4.565602e-11 1.167471e-10 ] [ 6.414148e-11 2.926013000000001e-10 4.472085e-11 ] [ 2.560781e-11 2.125953e-10 2.651252e-10 ] [ 2.793307e-10 1.807352e-11 2.367537e-10 ] [ 2.546309e-10 2.149048e-10 8.335699e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.9707798 0.0442718 -0.2324611 ] [ -3.3329063 0.7190539 -0.4459044 ] [ 0.1285876 0.4405524 0.3591541 ] [ -1.003291 0.8706097 -0.9320407 ] [ 3.2368299 -2.0744878 1.2512522 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.5553606995049e-09 7.093124292073345e-11 -3.724437396654509e-10 ] [ -5.339904553177031e-09 1.152051347675061e-09 -7.144176047918516e-10 ] [ 2.060200464447821e-10 7.058427555173299e-10 5.754283022844653e-10 ] [ -1.607449384059053e-09 1.394870507181702e-09 -1.493293819174067e-09 ] [ 5.185973191286401e-09 -3.323695853294826e-09 2.004727021564566e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -3.729314399234948 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.975020342067031e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.6479724 0.571567 0.8869957 ] [ 0.6508718 2.9324747 0.7343222 ] [ 0.3078742 1.8940452 2.8189851 ] [ 2.3200664 0.7009092 2.5557078 ] [ 2.6630449 1.7393134 0.4710275 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.479724000000001e-11 5.715670000000001e-11 8.869957000000001e-11 ] [ 6.508718e-11 2.9324747e-10 7.343222e-11 ] [ 3.078742e-11 1.8940452e-10 2.8189851e-10 ] [ 2.3200664e-10 7.009092e-11 2.5557078e-10 ] [ 2.6630449e-10 1.7393134e-10 4.710275e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.98e-05 -4.3e-05 8.8e-06 ] [ 6.8e-06 -9.8e-06 1.51e-05 ] [ 6.45e-05 5.2e-06 -3.85e-05 ] [ -4.16e-05 2.79e-05 -4.62e-05 ] [ -9.9e-06 1.97e-05 6.08e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.172309709184e-14 -6.889359469439999e-14 1.409915426304e-14 ] [ 1.089480102144e-14 -1.570133088384e-14 2.419286697408e-14 ] [ 1.033403920416e-13 8.33131842816e-15 -6.16837999008e-14 ] [ -6.665054742528e-14 4.470072772032e-14 -7.402055988096e-14 ] [ -1.586154854592e-14 3.156287942976e-14 9.741233854464e-14 ] ] } "relaxed-potential-energy" { "source-value" -5.34072039923495 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.55677736188388e-19 } }