{ "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" [ [ 0.5772238 -0.3016631 -1.5895063 ] [ -2.5850834 -0.7378522 2.2450429 ] [ 0.7547414 0.7175628 -2.027371 ] [ -1.9347837 2.2870138 -1.3450368 ] [ 0.0962707 -0.7706349 1.9937956 ] [ -0.8121877 -0.6629631 1.9346462 ] [ 3.7445093 0.3711311 -1.5939181 ] [ 0.1593096 -0.9025945 0.3823475 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.248144849486891e-10 -4.833175701600053e-10 -2.546669853455794e-09 ] [ -4.141760220421275e-09 -1.182169554185495e-09 3.596955276707598e-09 ] [ 1.209229035792447e-09 1.149662351587615e-09 -3.248206444649214e-09 ] [ -3.099865235984066e-09 3.664200071995549e-09 -2.154986532830131e-09 ] [ 1.542426660788238e-10 -1.234693230124927e-09 3.19441272329201e-09 ] [ -1.301268155362202e-09 -1.062183988024205e-09 3.099644936696891e-09 ] [ 5.999365306255695e-09 5.946175765707174e-10 -2.553738336329675e-09 ] [ 2.552421186918864e-10 -1.446115817876913e-09 6.12588230568315e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -35.421433 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.675139229539652e-18 } }