{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-periodic-cell-vector-1" { "source-unit" "angstrom" "source-value" [ 5.29616 0 0 ] "si-unit" "m" "si-value" [ 5.29616e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.242438 5.47618 0 ] "si-unit" "m" "si-value" [ -2.42438e-11 5.47618e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.11809 -0.0034447 5.45685 ] "si-unit" "m" "si-value" [ 1.1809e-11 -3.4447e-13 5.456850000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0183909 -0.0832388 -0.0590634 ] [ 1.37993 1.35458 1.33752 ] [ -0.123201 2.75975 2.68859 ] [ 1.45379 4.06883 4.12913 ] [ 2.80695 0.0674874 2.75473 ] [ 4.11558 1.36445 4.01895 ] [ 2.83757 2.84317 -0.0421665 ] [ 3.94058 4.22423 1.31424 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.83909e-12 -8.32388e-12 -5.90634e-12 ] [ 1.37993e-10 1.35458e-10 1.33752e-10 ] [ -1.23201e-11 2.75975e-10 2.68859e-10 ] [ 1.45379e-10 4.06883e-10 4.12913e-10 ] [ 2.80695e-10 6.748740000000001e-12 2.75473e-10 ] [ 4.11558e-10 1.36445e-10 4.01895e-10 ] [ 2.83757e-10 2.84317e-10 -4.21665e-12 ] [ 3.94058e-10 4.224230000000001e-10 1.31424e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.3027625 1.8934216 -1.4448477 ] [ -0.1842848 0.6704936 -0.226485 ] [ 2.3869344 0.8188605 -0.7598754 ] [ -1.5128319 -0.3458509 -0.4307793 ] [ -0.5767411 -0.392288 -1.1684655 ] [ 0.1056338 -0.3154314 1.4636516 ] [ -1.5859187 -1.6228662 0.1522956 ] [ -0.9355542 -0.7063392 2.4145057 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.68943224075496e-09 3.03359582083773e-09 -2.314901205556652e-09 ] [ -2.952567981288039e-10 1.074249170316027e-09 -3.62868971961888e-10 ] [ 3.824290491063275e-09 1.311959148796598e-09 -1.217454600601048e-09 ] [ -2.423823901380444e-09 -5.541142262626388e-10 -6.901845231845895e-10 ] [ -9.24041106674475e-10 -6.285146622203905e-10 -1.872088106311382e-09 ] [ 1.692440047262631e-10 -5.053768145462131e-10 2.345028374516513e-09 ] [ -2.540921863629529e-09 -2.600118284326537e-09 2.440044497707085e-10 ] [ -1.498923066731247e-09 -1.131680152594575e-09 3.868464583328338e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.061858038775913 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.733611005713531e-18 } }