{ "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" [ [ 0.9205003 -0.3354391 -1.1836842 ] [ -1.7320625 -0.1955146 1.9453396 ] [ 0.7992802 0.2951602 -1.9685133 ] [ -1.783953 1.5442093 -0.4860691 ] [ 0.4926533 -0.6067445 0.8875907 ] [ -0.8247712 -0.2940394 1.6546883 ] [ 2.7161196 -0.0852573 -1.4222978 ] [ -0.5877668 -0.3223746 0.5729458 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.474804060099386e-09 -5.374326837221932e-10 -1.896471151650352e-09 ] [ -2.7750700432644e-09 -3.132489211450637e-10 3.116777626636424e-09 ] [ 1.280588049908348e-09 4.728987718306521e-10 -3.153905986993857e-09 ] [ -2.858207789206022e-09 2.474096038081933e-09 -7.787685481132973e-10 ] [ 7.893175994199686e-10 -9.721118526989855e-10 1.422077068379506e-09 ] [ -1.321429134149161e-09 -4.711030522740595e-10 2.651102908971297e-09 ] [ 4.351703322416647e-09 -1.365972528125318e-10 -2.278772282975275e-09 ] [ -9.417062254424294e-10 -5.165010472597517e-10 9.179603657455526e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -36.222618 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.803503170376925e-18 } }