{ "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" [ [ 2.360944 2.643853 2.165766 ] [ 2.694587 4.80447 3.102481 ] [ 4.665525 1.923814 2.374826 ] [ 4.545146 3.928705 1.722535 ] [ 3.943017 3.203445 4.218269 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.360944e-10 2.643853e-10 2.165766e-10 ] [ 2.694587e-10 4.80447e-10 3.102481e-10 ] [ 4.665525e-10 1.923814e-10 2.374826e-10 ] [ 4.545146e-10 3.928705e-10 1.722535e-10 ] [ 3.943017e-10 3.203445e-10 4.218269e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.4288406 -0.6010008 -0.1749365 ] [ -0.7590749 1.722 -0.3436681 ] [ 0.9157334 -5.7093782 0.965327 ] [ -0.1573999 5.0865545 -1.6132342 ] [ 0.429582 -0.4981754 1.1665118 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.870783890305403e-10 -9.629094387753071e-10 -2.802791727337409e-10 ] [ -1.216172068235886e-09 2.758948163748e-09 -5.506169996711752e-10 ] [ 1.467166656453375e-09 -9.147432346708976e-09 1.546624363569318e-09 ] [ -2.521824419739366e-10 8.149558767467552e-09 -2.584686140409682e-09 ] [ 6.88266242786988e-10 -7.981649855136035e-10 1.868957949245281e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.445185 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.993938461280729e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4134815 2.6269607 2.1973768 ] [ 2.5979656 4.9319341 3.0692683 ] [ 4.6857226 1.6697808 2.3642827 ] [ 4.5242515 4.0668628 1.7854443 ] [ 3.9877979 3.2087486 4.1675049 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4134815e-10 2.6269607e-10 2.1973768e-10 ] [ 2.597965600000001e-10 4.9319341e-10 3.0692683e-10 ] [ 4.6857226e-10 1.6697808e-10 2.3642827e-10 ] [ 4.5242515e-10 4.0668628e-10 1.7854443e-10 ] [ 3.9877979e-10 3.2087486e-10 4.1675049e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.7e-06 4.1e-06 1.6e-06 ] [ -4.2e-06 3e-06 -2.6e-06 ] [ 0.0 -1.7e-06 9e-07 ] [ -3.3e-06 -1.6e-06 2.5e-06 ] [ 2.7e-06 -3.8e-06 -2.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.530230179799999e-15 6.568924199399999e-15 2.5634826144e-15 ] [ -6.729141862799999e-15 4.806529901999999e-15 -4.165659248399999e-15 ] [ 0.0 -2.7237002778e-15 1.4419589706e-15 ] [ -5.2871828922e-15 -2.5634826144e-15 4.005441585e-15 ] [ 4.3258769118e-15 -6.088271209199999e-15 -3.845223921599999e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.399219 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.146791559564885e-18 } }