{ "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" [ 5.30636 0 0 ] "si-unit" "m" "si-value" [ 5.30636e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0781877 5.44815 0 ] "si-unit" "m" "si-value" [ -7.81877e-12 5.44815e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.00200818 -0.0968672 5.44923 ] "si-unit" "m" "si-value" [ -2.00818e-13 -9.686720000000001e-12 5.44923e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0183636 0.00704735 0.0168371 ] [ 1.29138 1.3449 1.40641 ] [ -0.0614737 2.68753 2.83465 ] [ 1.25782 4.05715 4.11756 ] [ 2.70205 0.0250121 2.83894 ] [ 3.96698 1.43423 4.04452 ] [ 2.67871 2.79142 0.0958918 ] [ 4.00247 4.11579 1.29634 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.83636e-12 7.04735e-13 1.68371e-12 ] [ 1.29138e-10 1.3449e-10 1.40641e-10 ] [ -6.14737e-12 2.687530000000001e-10 2.83465e-10 ] [ 1.25782e-10 4.05715e-10 4.117560000000001e-10 ] [ 2.70205e-10 2.50121e-12 2.83894e-10 ] [ 3.96698e-10 1.43423e-10 4.044520000000001e-10 ] [ 2.67871e-10 2.79142e-10 9.589180000000001e-12 ] [ 4.00247e-10 4.11579e-10 1.29634e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.17896520000000002 1.6457811000000004 -1.3396965000000003 ] [ 0.7426635000000001 0.31383950000000005 0.7008816000000001 ] [ 0.7626365000000003 1.2033392000000003 -2.6346467000000002 ] [ 1.0531972000000003 -0.3137921000000001 1.1136779000000003 ] [ -0.4257528000000001 -0.8851496000000002 -2.4745332000000007 ] [ 0.12424730000000003 -1.6282115000000004 2.8438352000000005 ] [ -1.6282276000000004 -0.3256257000000001 -1.4826904000000003 ] [ -0.8077293000000002 -0.010180900000000001 3.273172100000001 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.867338593767962e-10 2.636832001374508e-09 -2.146430411267588e-09 ] [ 1.189878096821501e-09 5.028263095835617e-10 1.122936113468897e-09 ] [ 1.22187837046874e-09 1.927961933132176e-09 -4.221169346807872e-09 ] [ 1.687407930932022e-09 -5.027503664117358e-10 1.784308694481641e-09 ] [ -6.821311824001384e-10 -1.418165995030472e-09 -3.964639240433412e-09 ] [ 1.990661192575239e-10 -2.6086823990177e-09 4.556326270848093e-09 ] [ -2.608708194061295e-09 -5.217098836716347e-10 -2.375531894764601e-09 ] [ -1.29412500039515e-09 -1.631159995870272e-11 5.244199814474841e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.308342 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.817237669241072e-18 } }