{ "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" [ [ -0.5102374 0.1591291 -3.5031294 ] [ 0.5367109 0.0844533 0.0389877 ] [ -1.2483848 2.6128672 -4.0961894 ] [ -0.6563787 0.1840998 4.7136009 ] [ 0.704596 -0.2528546 -2.6256494 ] [ -0.046252 -1.7150279 5.513051 ] [ -0.5653849 -0.1535527 -2.2248729 ] [ 1.7853308 -0.9191142 2.1842015 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.174904333377779e-10 2.549529237089453e-10 -5.612632024317132e-09 ] [ 8.599056561085267e-10 1.353091028094086e-10 6.246518143876416e-11 ] [ -2.000132940322084e-09 4.186274741095158e-09 -6.562818891048779e-09 ] [ -1.051634607531097e-09 2.949603954539559e-10 7.55202116176184e-09 ] [ 1.128887238309197e-09 -4.051177285817357e-10 -4.206754083097547e-09 ] [ -7.410387306524161e-11 -2.74777760539972e-09 8.832881421478061e-09 ] [ -9.058464685333458e-10 -2.460185460007162e-10 -3.564639344631496e-09 ] [ 2.860415268154161e-09 -1.472583283085295e-09 3.499476578416291e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.397789 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.671350996381142e-18 } }