{ "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" [ [ -0.10783439999999998 -0.5400382999999999 0.5992262999999999 ] [ 2.6850203999999995 -2.3391606999999994 -3.5146128999999995 ] [ -1.2385803999999998 0.8942466999999998 4.863302799999999 ] [ -0.9554440999999999 0.6009471999999999 -0.8835844999999999 ] [ -4.174590599999999 -5.175946799999999 -4.331220599999999 ] [ 4.976062099999999 5.663181499999999 4.192327199999999 ] [ 0.39571989999999996 -1.4290339999999997 0.7321756999999999 ] [ -1.5803528999999998 2.3258044999999994 -1.6576138999999999 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.727697545979955e-10 -8.652367385965764e-10 9.600663684284868e-10 ] [ 4.301876911251063e-09 -3.747748585834162e-09 -5.631030619542087e-09 ] [ -1.984424559861112e-09 1.432741155967551e-09 7.791870046031176e-09 ] [ -1.530790199501297e-09 9.628235541752215e-10 -1.415658428401257e-09 ] [ -6.688431460731444e-09 -8.292780953464572e-09 -6.939380384847347e-09 ] [ 7.97253036026895e-09 9.073416998647075e-09 6.716848626583924e-09 ] [ 6.340131721653138e-10 -2.289564865128307e-09 1.173074788857874e-09 ] [ -2.53200446899348e-09 3.726349594451432e-09 -2.655790236893109e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -61.998284 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.93322011545187e-18 } }