{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.49393e-10 0.0 0.0 ] "source-value" [ 5.49393 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 2.595e-13 5.45604e-10 0.0 ] "source-value" [ 0.002595 5.45604 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -6.981170000000001e-12 7.48179e-12 5.57684e-10 ] "source-value" [ -0.0698117 0.0748179 5.57684 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 1.111584692110529e-09 -6.868718628034233e-10 -2.851143792484915e-09 ] [ -4.555788900809477e-09 -9.586147964100423e-10 4.014311682425735e-09 ] [ 1.401975359406639e-09 1.042747814468505e-09 -3.596270957438289e-09 ] [ -3.506966754118532e-09 4.248789750226829e-09 -2.183308671854513e-09 ] [ 1.386012553298285e-10 -1.347543171109242e-09 3.26277340772423e-09 ] [ -1.617400503050842e-09 -8.484863024614368e-10 3.535625047552443e-09 ] [ 6.761257758159261e-09 2.362201144408896e-11 -2.892750556932808e-09 ] [ 2.667372531902534e-10 -1.473643603572941e-09 7.107638410081171e-10 ] ] "source-value" [ [ 0.6937966 -0.4287117 -1.779544 ] [ -2.8434998 -0.5983203 2.5055363 ] [ 0.8750442 0.650832 -2.2446158 ] [ -2.1888765 2.651886 -1.3627141 ] [ 0.0865081 -0.8410703 2.036463 ] [ -1.009502 -0.5295835 2.2067636 ] [ 4.2200452 0.0147437 -1.8055129 ] [ 0.1664843 -0.919776 0.4436239 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "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 ] ] "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 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.657487201863697e-18 "source-value" -35.311258 } }