{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.46441e-10 0.0 0.0 ] "source-value" [ 5.46441 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 2.39301e-11 5.60761e-10 0.0 ] "source-value" [ 0.239301 5.60761 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.67861e-11 -7.33416e-11 5.71653e-10 ] "source-value" [ 0.167861 -0.733416 5.71653 ] } "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" [ [ 8.351070061541223e-10 -5.513685281222751e-09 -5.214541602611887e-09 ] [ 6.068765940423056e-09 3.051031668131247e-09 -5.35982537640941e-09 ] [ -2.208068869570018e-09 3.009311149143278e-09 4.388626924601943e-09 ] [ 1.87672576675795e-09 -8.497477121367589e-09 1.227732707819376e-08 ] [ -4.465690338321126e-09 6.307795792003843e-09 4.227722409404606e-09 ] [ -1.516280567588008e-09 -3.451713290085312e-10 1.482714166293938e-09 ] [ 2.299922936981779e-10 1.065111492416384e-08 -3.193923552451578e-09 ] [ -8.205513917718163e-10 -8.662919801843341e-09 -8.60809988680371e-09 ] ] "source-value" [ [ 0.5212328 -3.4413717 -3.2546609 ] [ 3.7878258 1.9043042 -3.3453399 ] [ -1.3781682 1.8782643 2.7391655 ] [ 1.1713601 -5.3037081 7.6629049 ] [ -2.7872647 3.9370165 2.6387368 ] [ -0.9463879 -0.21543899999999996 0.9254374 ] [ 0.1435499 6.6479031 -1.9934903 ] [ -0.5121479 -5.4069693 -5.3727534 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 3.27702e-13 -3.82766e-12 4.33443e-11 ] [ 1.09616e-10 1.45225e-10 1.46895e-10 ] [ 1.30178e-11 2.57242e-10 2.88603e-10 ] [ 1.56489e-10 3.87283e-10 4.500250000000001e-10 ] [ 2.74098e-10 -2.14768e-11 2.33093e-10 ] [ 4.21449e-10 1.24218e-10 3.87733e-10 ] [ 2.20243e-10 2.94328e-10 2.28142e-11 ] [ 4.00805e-10 4.02926e-10 1.38377e-10 ] ] "source-value" [ [ 0.00327702 -0.0382766 0.433443 ] [ 1.09616 1.45225 1.46895 ] [ 0.130178 2.57242 2.88603 ] [ 1.56489 3.87283 4.50025 ] [ 2.74098 -0.214768 2.33093 ] [ 4.21449 1.24218 3.87733 ] [ 2.20243 2.94328 0.228142 ] [ 4.00805 4.02926 1.38377 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.337009160094085e-18 "source-value" -14.586464 } }