{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.29616e-10 0.0 0.0 ] "source-value" [ 5.29616 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -2.42438e-11 5.47618e-10 0.0 ] "source-value" [ -0.242438 5.47618 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.1809e-11 -3.4447e-13 5.456850000000001e-10 ] "source-value" [ 0.11809 -0.0034447 5.45685 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 1.007560827544262e-08 7.89652390246651e-09 -6.214030808536454e-09 ] [ -3.265663734348153e-10 -1.097237008210071e-08 5.573276157803801e-09 ] [ -1.833189501005628e-09 5.241988970955798e-09 -1.036737072636146e-08 ] [ 8.157055765386744e-09 6.557115622931718e-09 5.412719955803825e-09 ] [ -9.787079177162219e-09 -2.667665890441803e-09 -2.852638142619135e-09 ] [ -2.298012822014461e-09 -1.382142655888404e-09 9.018731666443592e-09 ] [ -3.80432833167408e-09 2.34098111615471e-09 -1.166828398888128e-08 ] [ -1.834875151028371e-10 -7.01443082386016e-09 1.109759572612945e-08 ] ] "source-value" [ [ 6.2887001 4.9286226 -3.878493 ] [ -0.2038267 -6.8484148 3.4785654 ] [ -1.1441869 3.2717922 -6.4708039 ] [ 5.0912338 4.0926297 3.3783541 ] [ -6.1086144 -1.6650261 -1.7804767 ] [ -1.4343068 -0.8626656 5.6290496 ] [ -2.374475 1.4611255 -7.2827701 ] [ -0.11452390000000001 -4.3780634 6.9265745 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "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 ] ] "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 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.581992699997765e-18 "source-value" -16.115531 } }