{ "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" [ [ 1.175063 2.090387 1.108777 ] [ 2.290473 2.943113 3.7458 ] [ 1.562387 4.346014 1.227002 ] [ 3.205072 1.346551 2.036178 ] [ 4.414518 1.768723 4.119804 ] [ 3.44377 3.554925 2.238453 ] [ 4.008705 3.851776 5.027783 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.175063e-10 2.090387e-10 1.108777e-10 ] [ 2.290473e-10 2.943113e-10 3.7458e-10 ] [ 1.562387e-10 4.346014000000001e-10 1.227002e-10 ] [ 3.205072e-10 1.346551e-10 2.036178e-10 ] [ 4.414518e-10 1.768723e-10 4.119804e-10 ] [ 3.44377e-10 3.554925e-10 2.238453e-10 ] [ 4.008705e-10 3.851776e-10 5.027783000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.2358714 0.2352728 0.5219649 ] [ -4.6798174 -1.4164417 2.7567567 ] [ -1.2259875 0.9349336 0.370466 ] [ 0.7938392 -2.7109976 0.1009104 ] [ 0.0025211 -0.4085846 -0.1748373 ] [ 4.6950626 2.9198675 -2.718342 ] [ 0.1785106 0.4459499 -0.8569187 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.779076425953651e-10 3.769485796701542e-10 8.362799596582099e-10 ] [ -7.497894027893043e-09 -2.269389776466208e-09 4.416811133973759e-09 ] [ -1.96424850989304e-09 1.497928755920379e-09 5.935519640012928e-10 ] [ 1.271870606914575e-09 -4.343496973764911e-09 1.616762836755763e-10 ] [ 4.03924747869888e-12 -6.546246937389197e-10 -2.801202345037958e-10 ] [ 7.522319530912461e-09 4.678143444333744e-09 -4.355263999738713e-09 ] [ 2.860055098849805e-10 7.144905038280979e-10 -1.372935107066329e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -26.604144 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.26245375331966e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.1073692 2.0104891 1.433117 ] [ 1.8733516 2.7675505 3.6181232 ] [ 1.7274631 4.3137781 1.7083319 ] [ 3.360426 1.2804716 1.8895069 ] [ 4.142546 1.8095973 4.0187923 ] [ 4.0879256 3.6765791 2.2598616 ] [ 3.8009064 4.0430234 4.5760641 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1073692e-10 2.0104891e-10 1.433117e-10 ] [ 1.8733516e-10 2.7675505e-10 3.6181232e-10 ] [ 1.7274631e-10 4.313778100000001e-10 1.7083319e-10 ] [ 3.360426e-10 1.2804716e-10 1.8895069e-10 ] [ 4.142546000000001e-10 1.8095973e-10 4.0187923e-10 ] [ 4.0879256e-10 3.6765791e-10 2.2598616e-10 ] [ 3.8009064e-10 4.0430234e-10 4.5760641e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.55e-05 1.22e-05 2.6e-05 ] [ -1.89e-05 -2e-06 1.6e-05 ] [ -8e-07 1.45e-05 -3.08e-05 ] [ 3.8e-06 2.84e-05 -2.9e-06 ] [ 2.79e-05 -4.79e-05 7.7e-06 ] [ -1.92e-05 -2.03e-05 -2.8e-05 ] [ -1.84e-05 1.5e-05 1.2e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.08555038304e-14 1.954655477376e-14 4.16565921408e-14 ] [ -3.028113813312e-14 -3.2043532416e-15 2.56348259328e-14 ] [ -1.28174129664e-15 2.32315610016e-14 -4.934703992064001e-14 ] [ 6.08827115904e-15 4.550181603071999e-14 -4.646312200320001e-15 ] [ 4.470072772032e-14 -7.674426013632e-14 1.233675998016e-14 ] [ -3.076179111936e-14 -3.252418540224e-14 -4.48609453824e-14 ] [ -2.948004982272e-14 2.4032649312e-14 1.92261194496e-14 ] ] } "relaxed-potential-energy" { "source-value" -30.286855 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.852489099855959e-18 } }