{ "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" [ 5.36838 0 0 ] "si-unit" "m" "si-value" [ 5.368380000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0320632 5.46183 0 ] "si-unit" "m" "si-value" [ -3.20632e-12 5.46183e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0835799 0.195471 5.46165 ] "si-unit" "m" "si-value" [ -8.35799e-12 1.95471e-11 5.461649999999999e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0445787 0.0905296 0.00673122 ] [ 1.23056 1.45848 1.40837 ] [ -0.162897 2.78891 2.76222 ] [ 1.2265 4.23635 3.86532 ] [ 2.68005 0.105406 2.5782 ] [ 3.88338 1.64051 4.20954 ] [ 2.69942 2.77008 0.000613011 ] [ 4.15957 4.14184 1.16379 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.45787e-12 9.05296e-12 6.731220000000001e-13 ] [ 1.23056e-10 1.45848e-10 1.40837e-10 ] [ -1.62897e-11 2.78891e-10 2.76222e-10 ] [ 1.2265e-10 4.23635e-10 3.86532e-10 ] [ 2.68005e-10 1.05406e-11 2.5782e-10 ] [ 3.88338e-10 1.64051e-10 4.20954e-10 ] [ 2.69942e-10 2.77008e-10 6.13011e-14 ] [ 4.159570000000001e-10 4.14184e-10 1.16379e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.0870104000000005 0.40872770000000014 -1.8029727000000004 ] [ 0.3861654000000001 0.05688400000000001 -0.5675687000000001 ] [ 0.9541108000000003 0.5427375000000001 -0.8762198000000002 ] [ 0.26020280000000007 0.7299802000000001 1.7221747000000005 ] [ 0.41023130000000013 0.04387400000000001 0.6726757000000001 ] [ -0.11962980000000002 -1.7378554000000004 -1.3589968000000001 ] [ -1.5075221000000005 0.7336055000000001 -0.05332910000000001 ] [ -2.4705688000000006 -0.7779535000000002 2.2642366000000003 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.343759270246457e-09 6.548539652133564e-10 -2.888680707880653e-09 ] [ 6.187051756418805e-10 9.113821489758721e-11 -9.093453018378492e-10 ] [ 1.528654017412785e-09 8.695613337314402e-10 -1.403858878242052e-09 ] [ 4.168908428266984e-10 1.169557210086908e-09 2.759228041273254e-09 ] [ 6.572629979803914e-10 7.029389706097922e-11 1.077745279920275e-09 ] [ -1.916680687109799e-10 -2.784351292211033e-09 -2.177352900702014e-09 ] [ -2.415316663959321e-09 1.175365580990295e-09 -8.544263722830531e-11 ] [ -3.958287571437912e-09 -1.246418909769533e-09 3.627706944479681e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.896923 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.75132107892578e-18 } }