{ "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" [ [ 1.4975727 1.2036256 -1.3106949 ] [ -0.0098274 0.5385825 -0.2018459 ] [ 1.4427226 0.8070746 -0.8239429 ] [ -0.6805613 -0.9635919 -0.0104495 ] [ -1.259147 0.0992964 -0.9164369 ] [ 0.4206008 -0.4653222 1.1088101 ] [ -1.016713 -1.1637184 0.2275119 ] [ -0.3946474 -0.0559466 1.9270482 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.399375967888332e-09 1.928420796516373e-09 -2.099964725781794e-09 ] [ -1.574523052324992e-11 8.62904289872016e-10 -3.233927819843347e-10 ] [ 2.31149642001979e-09 1.293076055361512e-09 -1.320102051254152e-09 ] [ -1.090379403881255e-09 -1.543844414172251e-09 -1.67419445990496e-11 ] [ -2.017375885550458e-09 1.590903706096051e-10 -1.468293775618428e-09 ] [ 6.738767684497766e-10 -7.455283499792217e-10 1.77650961912691e-09 ] [ -1.62895379866343e-09 -1.864482413674783e-09 3.645142471337875e-10 ] [ -6.322948377395059e-10 -8.963633453324927e-11 3.087471573194723e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 662.75579 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.061851832037835e-16 } }