{ "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" [ 5.46847 0 0 ] "si-unit" "m" "si-value" [ 5.46847e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0752926 5.44594 0 ] "si-unit" "m" "si-value" [ 7.52926e-12 5.44594e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.00412544 0.201844 5.40303 ] "si-unit" "m" "si-value" [ 4.12544e-13 2.01844e-11 5.40303e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.00347607 -0.00350605 -0.096896 ] [ 1.33363 1.43287 1.45525 ] [ -0.0378093 2.6958 2.61111 ] [ 1.37012 4.12622 4.01894 ] [ 2.67267 0.0858706 2.76525 ] [ 3.9434 1.3374 3.96298 ] [ 2.74102 2.68949 -0.0467586 ] [ 4.13757 3.9786 1.32692 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.47607e-13 -3.50605e-13 -9.6896e-12 ] [ 1.33363e-10 1.43287e-10 1.45525e-10 ] [ -3.78093e-12 2.6958e-10 2.61111e-10 ] [ 1.37012e-10 4.12622e-10 4.01894e-10 ] [ 2.67267e-10 8.58706e-12 2.76525e-10 ] [ 3.9434e-10 1.3374e-10 3.96298e-10 ] [ 2.74102e-10 2.68949e-10 -4.67586e-12 ] [ 4.137570000000001e-10 3.9786e-10 1.32692e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.35684769999999993 -0.5184328999999999 1.4879171999999998 ] [ 0.8353481999999999 -1.6336509999999997 -2.8338708999999995 ] [ -0.4386360999999999 0.7723818999999998 2.8754942999999997 ] [ -0.6443453999999998 0.14740239999999996 -0.7171180999999999 ] [ -1.9598623999999998 -1.2564936999999998 -1.0377758999999998 ] [ 2.3956187999999994 2.4625547999999995 1.4414191999999997 ] [ -0.07347959999999999 -0.9794969999999998 0.7178699999999999 ] [ 0.24220409999999998 1.0057354999999997 -1.9339358999999998 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.717330468366416e-10 -8.306210786768583e-10 2.383906171166704e-09 ] [ 1.338375367293958e-09 -2.617397460310733e-09 -4.54036173975255e-09 ] [ -7.027725102488871e-10 1.237492232704524e-09 4.607049778660186e-09 ] [ -1.032355144105383e-09 2.361646810755215e-10 -1.148949863638475e-09 ] [ -3.140045743135161e-09 -2.013124846908205e-09 -1.66270029830832e-09 ] [ 3.838204465331118e-09 3.945447760504542e-09 2.309408162038972e-09 ] [ -1.177272981956664e-10 -1.569327206473097e-09 1.15015454024958e-09 ] [ 3.880537496789994e-10 1.611365918084306e-09 -3.09850691063376e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.117735 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.466263782200399e-18 } }