{ "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" [ 5.46856 0 0 ] "si-unit" "m" "si-value" [ 5.46856e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.109414 5.47364 0 ] "si-unit" "m" "si-value" [ 1.09414e-11 5.47364e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0853482 0.188746 5.50226 ] "si-unit" "m" "si-value" [ 8.53482e-12 1.88746e-11 5.50226e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.111998 0.00598912 -0.142628 ] [ 1.42992 1.39997 1.14788 ] [ 0.0344059 2.83471 2.60329 ] [ 1.5648 4.17845 4.01026 ] [ 2.81953 0.00757671 2.62729 ] [ 4.17997 1.38562 3.91338 ] [ 2.81257 2.67111 -0.166315 ] [ 4.15871 3.96748 1.06238 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.11998e-11 5.98912e-13 -1.42628e-11 ] [ 1.42992e-10 1.39997e-10 1.14788e-10 ] [ 3.44059e-12 2.83471e-10 2.60329e-10 ] [ 1.5648e-10 4.17845e-10 4.01026e-10 ] [ 2.81953e-10 7.576710000000001e-13 2.62729e-10 ] [ 4.17997e-10 1.38562e-10 3.91338e-10 ] [ 2.81257e-10 2.67111e-10 -1.66315e-11 ] [ 4.15871e-10 3.96748e-10 1.06238e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.435993 -1.3390583 -0.7943775 ] [ -0.0462104 -0.1221208 2.1467532 ] [ 1.1786552 -0.9530363 -0.4258905 ] [ -0.9540674 0.3727814 -0.7382806 ] [ -0.4287267 -0.3647708 -1.7558881 ] [ 0.5565356 0.9475096 0.9660807 ] [ -0.1905596 -1.3717052 -1.4343714 ] [ 1.3203662 2.8304005 2.0359742 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.300714431187562e-09 -2.145407919823762e-09 -1.272733069075335e-09 ] [ -7.403722312779359e-11 -1.956590922853872e-10 3.439477816004728e-09 ] [ 1.888413820982596e-09 -1.526932491213814e-09 -6.82351807742577e-10 ] [ -1.528584495541131e-09 5.972616486698075e-10 -1.1828559266555e-09 ] [ -6.868959011119278e-10 -5.844272525254871e-10 -2.813242885738655e-09 ] [ 8.916683343091703e-10 1.518077741610686e-09 1.547831924098364e-09 ] [ -3.053101385043864e-10 -2.197714020176297e-09 -2.298116341557867e-09 ] [ 2.115459873963371e-09 4.534801545961916e-09 3.261990290666843e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.171603 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.79532971409243e-18 } }