{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.46402e-10 0.0 0.0 ] "source-value" [ 5.46402 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.22514e-12 5.464470000000001e-10 0.0 ] "source-value" [ 0.0122514 5.46447 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -3.848410000000001e-12 7.69758e-12 5.42124e-10 ] "source-value" [ -0.0384841 0.0769758 5.42124 ] } "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" [ [ -8.321398711829978e-09 -3.818227213859519e-11 -2.965981243739714e-09 ] [ 4.842307267430774e-09 8.197100407629356e-09 2.725378214934964e-09 ] [ 4.305409230046942e-09 -2.511695278148219e-09 1.693501008620924e-09 ] [ -2.717446799791355e-09 1.051609613575812e-09 -9.24822776604231e-09 ] [ -2.004753938131796e-10 -2.518238247032243e-09 -1.906093183564228e-09 ] [ 6.364525661793129e-09 -2.187842991909039e-09 -3.304627548242375e-09 ] [ -1.47992205309687e-09 -3.649786700708588e-09 1.087173913094254e-08 ] [ -2.792999200739462e-09 1.657035468731516e-09 2.134311226872532e-09 ] ] "source-value" [ [ -5.1938086 -0.0238315 -1.8512199 ] [ 3.0223305 5.1162277 1.7010473 ] [ 2.6872251 -1.5676769 1.0570002 ] [ -1.6960969 0.6563631 -5.7722898 ] [ -0.1251269 -1.5717607 -1.1896898 ] [ 3.9724245 -1.3655442 -2.0625863 ] [ -0.9236947 -2.2780177 6.7856059 ] [ -1.743253 1.0342402 1.3321323 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.84284e-11 -1.40014e-12 7.582920000000001e-14 ] [ 1.32272e-10 1.33713e-10 1.35336e-10 ] [ -1.67119e-11 2.81332e-10 2.70768e-10 ] [ 1.35941e-10 4.15239e-10 4.11153e-10 ] [ 2.7301e-10 3.28947e-12 2.73301e-10 ] [ 3.99842e-10 1.37193e-10 4.148240000000001e-10 ] [ 2.79546e-10 2.80288e-10 -1.67e-11 ] [ 4.150070000000001e-10 4.1513e-10 1.18971e-10 ] ] "source-value" [ [ 0.184284 -0.0140014 0.000758292 ] [ 1.32272 1.33713 1.35336 ] [ -0.167119 2.81332 2.70768 ] [ 1.35941 4.15239 4.11153 ] [ 2.7301 0.0328947 2.73301 ] [ 3.99842 1.37193 4.14824 ] [ 2.79546 2.80288 -0.167 ] [ 4.15007 4.1513 1.18971 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.61204114157938e-18 "source-value" -35.027606 } }