{ "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" [ 5.41852 0 0 ] "si-unit" "m" "si-value" [ 5.418520000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.038783 5.47951 0 ] "si-unit" "m" "si-value" [ 3.8783e-12 5.479510000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.00323821 0.0198894 5.39896 ] "si-unit" "m" "si-value" [ 3.23821e-13 1.98894e-12 5.39896e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0136142 -0.0297439 -0.141562 ] [ 1.34075 1.30471 1.3715 ] [ -0.0280615 2.73239 2.73273 ] [ 1.33689 4.08129 3.93514 ] [ 2.80172 0.157681 2.72105 ] [ 4.07194 1.39009 4.01929 ] [ 2.65272 2.79754 0.0144035 ] [ 4.02421 4.07244 1.32124 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.36142e-12 -2.97439e-12 -1.41562e-11 ] [ 1.34075e-10 1.30471e-10 1.3715e-10 ] [ -2.80615e-12 2.73239e-10 2.73273e-10 ] [ 1.33689e-10 4.08129e-10 3.93514e-10 ] [ 2.80172e-10 1.57681e-11 2.72105e-10 ] [ 4.07194e-10 1.39009e-10 4.01929e-10 ] [ 2.65272e-10 2.79754e-10 1.44035e-12 ] [ 4.02421e-10 4.072440000000001e-10 1.32124e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.035956 -0.4443654 1.3282388 ] [ -0.4112775 0.671667 -0.7264878 ] [ -0.017443 -0.2849157 -1.2792098 ] [ 1.1108812 1.0743651 0.2647562 ] [ -1.2235607 -2.2869791 -0.8180088 ] [ 0.0180343 1.2300297 1.4799115 ] [ -0.2362721 -1.0966529 -0.4548788 ] [ 0.7955939 1.1368513 0.2056788 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.760786257748481e-11 -7.119518549724404e-10 2.128073152199447e-09 ] [ -6.58939195161072e-10 1.076129164362874e-09 -1.163961768456426e-09 ] [ -2.79467667966144e-11 -4.564852734388666e-10 -2.049520034658244e-09 ] [ 1.779827887126249e-09 1.721322645423454e-09 4.24186193851849e-10 ] [ -1.960360347669682e-09 -3.664144446278225e-09 -1.310594574968663e-09 ] [ 2.889413383249344e-11 1.970724828229638e-09 2.371079606153059e-09 ] [ -3.785496347673197e-10 -1.75703163751252e-09 -7.287961786575591e-10 ] [ 1.274681946231093e-09 1.821436574186087e-09 3.29533764754199e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -17.573466038775916 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.815579643374956e-18 } }