{ "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" [ 5.40836 0 0 ] "si-unit" "m" "si-value" [ 5.40836e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0676972 5.56169 0 ] "si-unit" "m" "si-value" [ 6.76972e-12 5.561689999999999e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0290382 0.0456166 5.46301 ] "si-unit" "m" "si-value" [ 2.90382e-12 4.56166e-12 5.46301e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.160852 -0.0174641 0.0414383 ] [ 1.3693 1.3835 1.35672 ] [ 0.168786 2.76991 2.61562 ] [ 1.32577 4.00891 4.07743 ] [ 2.71647 0.0672876 2.67609 ] [ 4.01486 1.47906 4.19059 ] [ 2.74225 2.69331 -0.0428987 ] [ 4.04746 4.06755 1.1226 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.60852e-11 -1.74641e-12 4.14383e-12 ] [ 1.3693e-10 1.3835e-10 1.35672e-10 ] [ 1.68786e-11 2.76991e-10 2.61562e-10 ] [ 1.32577e-10 4.008910000000001e-10 4.07743e-10 ] [ 2.71647e-10 6.728760000000001e-12 2.67609e-10 ] [ 4.01486e-10 1.47906e-10 4.19059e-10 ] [ 2.74225e-10 2.69331e-10 -4.28987e-12 ] [ 4.04746e-10 4.06755e-10 1.1226e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.6026748 -0.8143834 -2.5220954 ] [ 3.9935866 0.036648 -1.080817 ] [ -7.2888457 -0.4104534 0.2601804 ] [ 4.9551518 3.7463863 0.6842732 ] [ -0.0686666 -2.543662 1.2558846 ] [ 5.8362346 -4.091666 -4.7476305 ] [ -6.1031898 0.9994572 1.3866537 ] [ 3.2784039 3.0776734 4.7635509 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.374298018460623e-09 -1.304786054597475e-09 -4.040842318598883e-09 ] [ 6.398431136375504e-09 5.8716569282832e-11 -1.731659743029978e-09 ] [ -1.167801826937137e-08 -6.576188468258556e-10 4.168549575047735e-10 ] [ 7.939028431883041e-09 6.002372591797714e-09 1.096326532312409e-09 ] [ -1.100160220562244e-10 -4.075395821193708e-09 2.012148961120436e-09 ] [ 9.350678706662335e-09 -6.555571659332243e-09 -7.606542653965736e-09 ] [ -9.778388090427131e-09 1.601306972523065e-09 2.221664157589646e-09 ] [ 5.252582125394472e-09 4.930976408563336e-09 7.63204994684967e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.056526 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.456457019241348e-18 } }