{ "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" [ [ 0.5435085 -0.5261836 -1.5981468 ] [ -2.6335612 -0.7520342 2.3313855 ] [ 0.5889457 0.6347295 -2.025037 ] [ -2.1779114 2.2635079 -1.2663113 ] [ 0.3405158 -0.9008953 2.0285763 ] [ -0.6425347 -0.4016786 1.923608 ] [ 3.8142038 0.3398343 -1.8010077 ] [ 0.1668335 -0.65728 0.406933 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.707966119060768e-10 -8.430390621683789e-10 -2.560513439566334e-09 ] [ -4.219430184085993e-09 -1.204891613282032e-09 3.735291342172119e-09 ] [ 9.435950314606907e-10 1.016948765432074e-09 -3.24446693765497e-09 ] [ -3.489398727253797e-09 3.626539438376104e-09 -2.028854359514855e-09 ] [ 5.455664537730086e-10 -1.443393387448602e-09 3.250137521368967e-09 ] [ -1.029454074392742e-09 -6.435600619956749e-10 3.081959765183847e-09 ] [ 6.11102815532652e-09 5.444745704059335e-10 -2.88553243082078e-09 ] [ 2.672967332662368e-10 -1.053078649319424e-09 6.519785388320064e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -35.183017 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.636940728660896e-18 } }