{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.37928e-10 0.0 0.0 ] "source-value" [ 5.37928 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -1.09609e-11 5.36452e-10 0.0 ] "source-value" [ -0.109609 5.36452 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -1.16688e-11 5.83163e-11 5.41925e-10 ] "source-value" [ -0.116688 0.583163 5.41925 ] } "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" [ [ 4.497204815995172e-08 -3.588056101228695e-08 5.847364902287997e-08 ] [ -4.447026262430102e-09 4.791160822947314e-09 -1.848968857890901e-09 ] [ -3.342478490255789e-10 -2.237260848036319e-09 2.018313959961936e-09 ] [ -9.363351045606258e-09 -9.519449671811842e-09 1.451859993670623e-08 ] [ 9.78294972713977e-09 9.198844677147702e-09 -5.180598529594266e-09 ] [ -4.381428409131753e-08 4.040851241474535e-08 -6.37208614100549e-08 ] [ -6.247773449258813e-09 -1.050321559703286e-08 -1.155978699138563e-08 ] [ 9.451684650329132e-09 3.741969054109951e-09 7.299652869377568e-09 ] ] "source-value" [ [ 28.069344899999997 -22.394884899999997 36.49638139999999 ] [ -2.7756154999999993 2.9904073999999996 -1.1540355999999998 ] [ -0.20862109999999998 -1.3963883999999998 1.2597324999999997 ] [ -5.844144099999999 -5.941573199999999 9.061797399999998 ] [ 6.106036999999999 5.741467299999999 -3.2334752999999994 ] [ -27.346725399999997 25.221009899999995 -39.77143379999999 ] [ -3.8995534999999997 -6.555591599999999 -7.215051599999999 ] [ 5.899277599999999 2.3355533999999993 4.5560849999999995 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -1.49607e-11 1.63517e-11 1.68021e-11 ] [ 1.37749e-10 1.37328e-10 1.35818e-10 ] [ 9.64456e-14 2.92001e-10 2.60942e-10 ] [ 1.4682e-10 4.32928e-10 3.69686e-10 ] [ 2.55926e-10 -7.70152e-12 2.34173e-10 ] [ 4.30694e-10 1.43375e-10 4.422170000000001e-10 ] [ 2.84059e-10 2.75554e-10 2.71651e-11 ] [ 3.86093e-10 4.12935e-10 1.26521e-10 ] ] "source-value" [ [ -0.149607 0.163517 0.168021 ] [ 1.37749 1.37328 1.35818 ] [ 0.000964456 2.92001 2.60942 ] [ 1.4682 4.32928 3.69686 ] [ 2.55926 -0.0770152 2.34173 ] [ 4.30694 1.43375 4.42217 ] [ 2.84059 2.75554 0.271651 ] [ 3.86093 4.12935 1.26521 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.214243337831258e-18 "source-value" -13.82022 } }