{ "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" [ [ 2.448876 1.489587 3.211478 ] [ 1.818052 3.686595 2.502768 ] [ 2.645526 3.343853 4.556562 ] [ 4.834539 1.578647 2.504909 ] [ 4.649923 2.062861 4.836234 ] [ 4.865091 3.729921 2.57452 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.448876e-10 1.489587e-10 3.211478e-10 ] [ 1.818052e-10 3.686595e-10 2.502768e-10 ] [ 2.645526e-10 3.343853e-10 4.556562e-10 ] [ 4.834539e-10 1.578647e-10 2.504909e-10 ] [ 4.649923e-10 2.062861e-10 4.836234000000001e-10 ] [ 4.865090999999999e-10 3.729921e-10 2.57452e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.1126388 -1.2396755 -1.8094342 ] [ -0.4344403 0.1516236 -1.6361057 ] [ 1.2497422 0.5311158 2.6759042 ] [ -1.0464019 -4.3809228 0.6745125 ] [ 0.5536223 1.7263634 -1.6923286 ] [ -0.2098834 3.2114956 1.7874517 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.80467251954967e-10 -1.98617910347855e-09 -2.899033172115952e-09 ] [ -6.960500917933383e-10 2.429277870815309e-10 -2.621330301697618e-09 ] [ 2.002307734867158e-09 8.509413176974887e-10 4.287271148740528e-09 ] [ -1.676520660140699e-09 -7.019012087689674e-09 1.08068815793736e-09 ] [ 8.870007058135238e-10 2.765939078484799e-09 -2.711409317631195e-09 ] [ -3.362702765740147e-10 5.145383168122069e-09 2.863813324549216e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.265704 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.445835404885304e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.253682 1.4556255 2.8957136 ] [ 2.3713132 3.8449452 2.6564777 ] [ 2.5000713 2.8477235 4.8402625 ] [ 4.5909725 1.32057 2.6962632 ] [ 4.8373643 2.7127143 4.6407818 ] [ 4.7086038 3.7098854 2.4569722 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.253682e-10 1.4556255e-10 2.8957136e-10 ] [ 2.3713132e-10 3.8449452e-10 2.6564777e-10 ] [ 2.5000713e-10 2.8477235e-10 4.8402625e-10 ] [ 4.590972500000001e-10 1.32057e-10 2.6962632e-10 ] [ 4.8373643e-10 2.7127143e-10 4.6407818e-10 ] [ 4.7086038e-10 3.7098854e-10 2.4569722e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.87e-05 -2.37e-05 1.14e-05 ] [ 7.1e-06 -1.52e-05 6.9e-06 ] [ -1.07e-05 4.95e-05 -2.15e-05 ] [ 4.25e-05 1.09e-05 -2.01e-05 ] [ 1.41e-05 -9e-06 -4.6e-05 ] [ -1.42e-05 -1.26e-05 6.93e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.200423522496e-14 -3.797158591296e-14 1.826481347712e-14 ] [ 1.137545400768e-14 -2.435308463616e-14 1.105501868352e-14 ] [ -1.714328984256e-14 7.930774272959999e-14 -3.44467973472e-14 ] [ 6.8092506384e-14 1.746372516672e-14 -3.220375007808e-14 ] [ 2.259069035328e-14 -1.44195895872e-14 -7.37001245568e-14 ] [ -2.275090801536e-14 -2.018742542208e-14 1.1103083982144e-13 ] ] } "relaxed-potential-energy" { "source-value" -18.816992 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.014814465618063e-18 } }