{ "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" [ [ 3.2688056 2.8516415 -2.1372891 ] [ -0.1065002 0.7772013 -0.2007515 ] [ 3.3202333 1.2549879 -1.1455672 ] [ -1.794422 -0.1016102 -0.522192 ] [ -0.5367228 -0.7465889 -1.655358 ] [ -0.1996495 -0.6692335 2.3133251 ] [ -2.4053103 -1.9222944 -0.1530343 ] [ -1.546434 -1.4441039 3.5008671 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.237203910260116e-09 4.568833342203044e-09 -3.424314627910673e-09 ] [ -1.706321305505242e-10 1.245213752515367e-09 -3.216393598905312e-10 ] [ 5.319600168861633e-09 2.010712272766888e-09 -1.835400985395318e-09 ] [ -2.874980976249178e-09 -1.627974868748122e-10 -8.366438139687936e-10 ] [ -8.599247220103143e-10 -1.196167280928789e-09 -2.652175886654247e-09 ] [ -3.198737612544096e-10 -1.072230267556157e-09 3.706355391529822e-09 ] [ -3.853731928429434e-09 -3.079855145974763e-09 -2.451879776404935e-10 ] [ -2.477660400410227e-09 -2.313709506586101e-09 5.609007420147895e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.562473 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.697736281843124e-18 } }