{ "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" [ [ -0.2262295 -0.1346966 -1.6185557 ] [ 0.4894541 0.1845968 -0.3261074 ] [ -0.0101617 1.8390374 -2.8192314 ] [ -0.4687852 -0.1189651 3.2981921 ] [ 0.7891587 -0.073718 -2.0123463 ] [ -1.0396755 -1.4124304 4.1154461 ] [ -0.4609196 -0.2533263 -1.3787366 ] [ 0.9271587 -0.0304978 0.7413392 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.624596188215029e-10 -2.158077451992444e-10 -2.593212123367513e-09 ] [ 7.841919224354993e-10 2.957566796711712e-10 -5.224816564544915e-10 ] [ -1.62808383017178e-11 2.946462751332111e-09 -4.516906674919107e-09 ] [ -7.510766938050168e-10 -1.906031034814734e-10 5.284286317063391e-09 ] [ 1.264371629657816e-09 -1.18109257105212e-10 -3.224134221376354e-09 ] [ -1.665743793042267e-09 -2.262962984031273e-09 6.593671579906427e-09 ] [ -7.384746132726262e-10 -4.058734786376742e-10 -2.208979564960605e-09 ] [ 1.485472005149816e-09 -4.886286254840519e-11 1.187756344108253e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.746677 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.727249063254521e-18 } }