{ "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" [ 5.44188 0 0 ] "si-unit" "m" "si-value" [ 5.44188e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0681259 5.43851 0 ] "si-unit" "m" "si-value" [ -6.812590000000001e-12 5.43851e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.00252152 -0.017859 5.5414 ] "si-unit" "m" "si-value" [ -2.52152e-13 -1.7859e-12 5.5414e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.00431502 -0.0137584 0.0307734 ] [ 1.33409 1.32426 1.37744 ] [ 0.0396224 2.60036 2.83022 ] [ 1.35045 4.04355 3.98016 ] [ 2.67673 0.013858 2.80413 ] [ 4.08887 1.41719 3.918 ] [ 2.72143 2.70354 0.017408 ] [ 3.9766 4.07774 1.36794 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.31502e-13 -1.37584e-12 3.07734e-12 ] [ 1.33409e-10 1.32426e-10 1.37744e-10 ] [ 3.962240000000001e-12 2.60036e-10 2.83022e-10 ] [ 1.35045e-10 4.04355e-10 3.98016e-10 ] [ 2.67673e-10 1.3858e-12 2.80413e-10 ] [ 4.08887e-10 1.41719e-10 3.918e-10 ] [ 2.72143e-10 2.70354e-10 1.7408e-12 ] [ 3.9766e-10 4.077740000000001e-10 1.36794e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.8573032 -0.6854661 -2.1851022 ] [ 0.3825083 0.2693008 -2.4875978 ] [ 0.2456125 2.6383967 -2.2516032 ] [ -0.7040283 0.2341417 3.7011473 ] [ 0.953621 -0.2580339 -0.4382303 ] [ -1.1704668 -1.5280468 4.3733503 ] [ -0.1730948 -0.6200706 -1.1411343 ] [ 1.3231513 -0.0502217 0.4291702 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.373551155293429e-09 -1.098237768819107e-09 -3.500919687741995e-09 ] [ 6.128458605710622e-10 4.314674492775072e-10 -3.985571069949805e-09 ] [ 3.93514608518325e-10 4.227177543962707e-09 -3.607466036079628e-09 ] [ -1.127977691934742e-09 3.751363607850378e-10 5.929891723052187e-09 ] [ 1.527869283891714e-09 -4.134158853598925e-10 -7.021223469708102e-10 ] [ -1.875294557832751e-09 -2.448200878618471e-09 7.006879662956889e-09 ] [ -2.773284440269032e-10 -9.934626267503603e-10 -1.828298711715946e-09 ] [ 2.119922096106724e-09 -8.04640342597578e-11 6.876064664491067e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -325.12712 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.20911074743714e-17 } }