{ "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" [ [ 1.715482 1.558119 0.3191032 ] [ 2.111919 2.384646 2.793656 ] [ 0.6473775 3.949576 0.9928713 ] [ 3.842985 1.188798 1.171985 ] [ 3.145034 3.056438 0.3971002 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.715482e-10 1.558119e-10 3.191032e-11 ] [ 2.111919e-10 2.384646e-10 2.793656e-10 ] [ 6.473775000000001e-11 3.949576e-10 9.928713000000001e-11 ] [ 3.842985e-10 1.188798e-10 1.171985e-10 ] [ 3.145034e-10 3.056438e-10 3.971002e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -9.9089626 -5.9765912 -1.7671322 ] [ -1.940158 1.858424 -0.7352779 ] [ 3.2367941 -3.0308068 1.4942418 ] [ 4.6075724 -5.3843461 2.9631983 ] [ 4.0047541 12.5333201 -1.9550299 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.587590821410158e-08 -9.575554692719017e-09 -2.83125789670287e-09 ] [ -3.108475788258086e-09 2.97752348433362e-09 -1.17804506117092e-09 ] [ 5.185915833363378e-09 -4.855887797121662e-09 2.394039277782109e-09 ] [ 7.382144777923345e-09 -8.62667343971566e-09 4.747567039054304e-09 ] [ 6.416323391072946e-09 2.008059244522272e-08 -3.132303198744962e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.4852242 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.039047459388638e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.4583505 1.4006528 0.2937488 ] [ 1.7878933 2.0308343 2.850146 ] [ 1.1648548 3.8676564 1.2257665 ] [ 3.8373727 1.5008114 1.4647221 ] [ 3.2143261 3.3376221 -0.1596677 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.4583505e-10 1.4006528e-10 2.937488e-11 ] [ 1.7878933e-10 2.0308343e-10 2.850146e-10 ] [ 1.1648548e-10 3.8676564e-10 1.2257665e-10 ] [ 3.8373727e-10 1.5008114e-10 1.4647221e-10 ] [ 3.2143261e-10 3.3376221e-10 -1.596677e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.15e-05 -4.8e-06 1.03e-05 ] [ -8.8e-06 -2.6e-06 1.88e-05 ] [ -1.75e-05 1.18e-05 1.6e-06 ] [ -1.18e-05 -8.9e-06 -1.94e-05 ] [ 1.67e-05 4.4e-06 -1.13e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.44467973472e-14 -7.69044777984e-15 1.650241919424e-14 ] [ -1.409915426304e-14 -4.16565921408e-15 3.012092047104e-14 ] [ -2.8038090864e-14 1.890568412544e-14 2.56348259328e-15 ] [ -1.890568412544e-14 -1.425937192512e-14 -3.108222644352e-14 ] [ 2.675634956736e-14 7.04957713152e-15 -1.810459581504e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.344147 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.657315048551846e-18 } }