{ "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" [ 5.55975 0 0 ] "si-unit" "m" "si-value" [ 5.55975e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00335003 5.48819 0 ] "si-unit" "m" "si-value" [ 3.35003e-13 5.488190000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0164792 -0.0422926 5.51812 ] "si-unit" "m" "si-value" [ 1.64792e-12 -4.22926e-12 5.51812e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0695878 -0.00317054 -0.0200442 ] [ 1.39636 1.32374 1.28539 ] [ -0.0674176 2.58156 2.68412 ] [ 1.50658 3.99879 4.14654 ] [ 2.80481 -0.0668971 2.57568 ] [ 4.18687 1.32364 3.96453 ] [ 2.74594 2.77319 -0.0797703 ] [ 4.04367 4.06467 1.27465 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -6.958780000000001e-12 -3.17054e-13 -2.00442e-12 ] [ 1.39636e-10 1.32374e-10 1.28539e-10 ] [ -6.74176e-12 2.58156e-10 2.68412e-10 ] [ 1.50658e-10 3.99879e-10 4.14654e-10 ] [ 2.80481e-10 -6.689710000000001e-12 2.57568e-10 ] [ 4.18687e-10 1.32364e-10 3.96453e-10 ] [ 2.74594e-10 2.77319e-10 -7.97703e-12 ] [ 4.04367e-10 4.06467e-10 1.27465e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.0283471 -0.1762143 -0.3227617 ] [ -0.017073 0.0745706 -0.0389192 ] [ 0.4192849 0.7817194 -0.1053745 ] [ -0.7064855 0.4524946 -0.5859432 ] [ -0.4425215 0.0689115 0.5295389 ] [ -0.2142694 -0.3060977 0.4802692 ] [ 0.1428265 -0.6676137 -0.0697262 ] [ 0.7898909 -0.2277703 0.1129166 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.541706088747968e-11 -2.823264317106374e-10 -5.171212498296634e-10 ] [ -2.73539614469184e-11 1.194752719190285e-10 -6.235543234023936e-11 ] [ 6.71768464234466e-10 1.252452546705803e-09 -1.688285603284896e-10 ] [ -1.131914551034199e-09 7.249762691582477e-10 -9.387844961567387e-10 ] [ -7.089976015013473e-10 1.104083942042592e-10 8.484148453841491e-10 ] [ -3.432974232328435e-10 -4.904225786206521e-10 7.694760839303193e-10 ] [ 2.288332791306912e-10 -1.069635061865785e-09 -1.11713687497225e-10 ] [ 1.265544732962671e-09 -3.649282495726023e-10 1.809123366202253e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 142.62574 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.285116261522994e-17 } }