{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.45404e-10 0.0 0.0 ] "source-value" [ 5.45404 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 2.69758e-13 5.32364e-10 0.0 ] "source-value" [ 0.00269758 5.32364 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -2.64471e-12 4.33477e-12 5.272210000000001e-10 ] "source-value" [ -0.0264471 0.0433477 5.27221 ] } "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" [ [ -2.397357705999111e-09 4.23350065938752e-09 5.13425509018464e-09 ] [ -2.916453958949234e-09 1.627452879605065e-09 -1.45949894749387e-09 ] [ -1.089350325837715e-10 -3.416888379055603e-10 -1.32397483258195e-09 ] [ 4.917860469467192e-09 -2.924596220536139e-09 -5.060993801804276e-09 ] [ -3.017260668882701e-10 3.240279969491833e-09 1.168729685862265e-09 ] [ 1.003472857874525e-09 -3.835608266712607e-09 -4.477179226433558e-09 ] [ -2.704748108112556e-10 2.146243277038278e-09 9.64252663677443e-09 ] [ 7.36144081075872e-11 -4.145583300150728e-09 -3.623864444290017e-09 ] ] "source-value" [ [ -1.496313 2.6423433 3.20455 ] [ -1.8203074 1.0157762 -0.9109476 ] [ -0.0679919 -0.2132654 -0.8263601 ] [ 3.0694871 -1.8253894 -3.1588239 ] [ -0.1883226 2.0224237 0.7294637 ] [ 0.6263185 -2.3939984 -2.7944355 ] [ -0.1688171 1.3395797 6.0183918 ] [ 0.0459465 -2.5874696 -2.2618383 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.65045e-12 3.66931e-12 2.59636e-12 ] [ 1.48655e-10 1.36127e-10 1.37402e-10 ] [ -1.76096e-12 2.76119e-10 2.70854e-10 ] [ 1.17184e-10 4.14313e-10 4.05378e-10 ] [ 2.72197e-10 2.31604e-12 2.74475e-10 ] [ 4.08411e-10 1.50063e-10 4.06205e-10 ] [ 2.69936e-10 2.73466e-10 -1.81062e-11 ] [ 4.07246e-10 4.14715e-10 1.4277e-10 ] ] "source-value" [ [ 0.0265045 0.0366931 0.0259636 ] [ 1.48655 1.36127 1.37402 ] [ -0.0176096 2.76119 2.70854 ] [ 1.17184 4.14313 4.05378 ] [ 2.72197 0.0231604 2.74475 ] [ 4.08411 1.50063 4.06205 ] [ 2.69936 2.73466 -0.181062 ] [ 4.07246 4.14715 1.4277 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.26049651419097e-18 "source-value" -32.833437 } }