{ "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" [ [ -2.435022475089187e-09 3.707206307533129e-09 3.89007634376631e-09 ] [ -2.250569167919332e-09 1.612527002205692e-09 -9.101834004281895e-10 ] [ 4.097768581950221e-10 -9.06914159033447e-10 -1.710213473170151e-09 ] [ 4.097057215530586e-09 -2.012725728126248e-09 -3.681397004566324e-09 ] [ -2.757799380380487e-10 1.690623499409967e-09 1.659377530515801e-09 ] [ 1.246027177585747e-09 -3.452734036810424e-09 -2.953490354368633e-09 ] [ -8.46427825939033e-10 2.13584547120461e-09 6.346908768541461e-09 ] [ 5.493815567424576e-11 -2.773828516600942e-09 -2.641078089854951e-09 ] ] "source-value" [ [ -1.5198215 2.3138562 2.4279947 ] [ -1.4046948 1.0064602 -0.5680918 ] [ 0.2557626 -0.5660513 -1.0674313 ] [ 2.557182 -1.2562446 -2.2977473 ] [ -0.1721283 1.0552042 1.035702 ] [ 0.777709 -2.1550271 -1.8434237 ] [ -0.5282987 1.3330899 3.9614289 ] [ 0.0342897 -1.7312876 -1.6484313 ] ] } "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" -5.721573786042711e-18 "source-value" -35.711255 } }