{ "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" [ [ 2.762123014209377e-09 -8.181548559824238e-10 -6.16078807616234e-09 ] [ -1.253167950610523e-08 -4.429825774882181e-09 1.047120426836694e-08 ] [ 5.054920911540797e-09 2.823144954948125e-09 -8.945430163430049e-09 ] [ -8.07627802560756e-09 1.050389475970242e-08 -6.19109933521593e-09 ] [ 2.115944995615315e-10 -2.723983840621882e-09 5.636623497689978e-09 ] [ -5.982041882333436e-09 -2.512251393653299e-09 8.730089935146747e-09 ] [ 1.896735350575121e-08 1.519389431103009e-09 -5.139628149700155e-09 ] [ -4.059925170166924e-10 -4.362213280613771e-09 1.599028023304804e-09 ] ] "source-value" [ [ 1.7239816 -0.5106521 -3.8452615 ] [ -7.8216592 -2.7648798 6.5356117 ] [ 3.1550335 1.7620685 -5.5832984 ] [ -5.0408163 6.5560155 -3.8641803 ] [ 0.1320669 -1.700177 3.5181037 ] [ -3.7336969 -1.568024 5.4488936 ] [ 11.838491 0.9483283 -3.2079036 ] [ -0.2534006 -2.7226794 0.9980348 ] ] } "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" -5.356821455463072e-18 "source-value" -33.43465 } }