{ "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" [ 5.49393 0 0 ] "si-unit" "m" "si-value" [ 5.49393e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.002595 5.45604 0 ] "si-unit" "m" "si-value" [ 2.595e-13 5.45604e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0698117 0.0748179 5.57684 ] "si-unit" "m" "si-value" [ -6.981170000000001e-12 7.48179e-12 5.57684e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0568347 0.000259582 0.0366732 ] [ 1.4042 1.34788 1.25876 ] [ -0.0116956 2.70772 2.89683 ] [ 1.4664 4.01047 4.21293 ] [ 2.72042 0.0465962 2.58375 ] [ 4.04434 1.40284 4.02526 ] [ 2.59741 2.72967 0.138309 ] [ 4.11134 4.10597 1.37335 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -5.683470000000001e-12 2.59582e-14 3.66732e-12 ] [ 1.4042e-10 1.34788e-10 1.25876e-10 ] [ -1.16956e-12 2.70772e-10 2.89683e-10 ] [ 1.4664e-10 4.01047e-10 4.21293e-10 ] [ 2.72042e-10 4.65962e-12 2.583750000000001e-10 ] [ 4.04434e-10 1.40284e-10 4.02526e-10 ] [ 2.59741e-10 2.72967e-10 1.38309e-11 ] [ 4.11134e-10 4.10597e-10 1.37335e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.4444277 -0.8991912 -3.059856 ] [ -3.7172559 -0.2767041 3.7365005 ] [ 1.0834738 0.5220851 -3.3208039 ] [ -3.539572 3.4747067 -1.0360657 ] [ 0.7417381 -1.3400174 2.6591324 ] [ -1.2164357 -0.3367673 3.3249713 ] [ 5.3662133 -0.4360337 -3.3916686 ] [ -0.1625894 -0.708078 1.08779 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.314228291375916e-09 -1.440663118269097e-09 -4.902429746214604e-09 ] [ -5.955700496510863e-09 -4.433288398995053e-10 5.98653374470751e-09 ] [ 1.735916391609335e-09 8.364725412880301e-10 -5.320514370841462e-09 ] [ -5.671019506038298e-09 5.56709383887712e-09 -1.659960242152787e-09 ] [ 1.188395442576613e-09 -2.146944549745202e-09 4.260399762891793e-09 ] [ -1.948944839246482e-09 -5.395606947099399e-10 5.327191281690983e-09 ] [ 8.597621491486017e-09 -6.98603000020921e-10 -5.434052136421467e-09 ] [ -2.604969354698995e-10 -1.134466017302822e-09 1.742831706340032e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.447275 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.519061865526832e-18 } }