{ "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" [ 5.47373 0 0 ] "si-unit" "m" "si-value" [ 5.47373e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.128217 5.8305 0 ] "si-unit" "m" "si-value" [ -1.28217e-11 5.8305e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.28854 -0.0943746 5.99929 ] "si-unit" "m" "si-value" [ 2.8854e-11 -9.437460000000001e-12 5.99929e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.153552 -0.151682 0.285368 ] [ 1.56659 1.11428 1.80298 ] [ 0.0114317 2.78427 2.63644 ] [ 1.58247 4.14354 3.67768 ] [ 2.87662 -0.0580046 2.88139 ] [ 4.22527 1.43863 4.17233 ] [ 2.56962 2.98931 0.105287 ] [ 4.06718 4.1162 1.17836 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.53552e-11 -1.51682e-11 2.85368e-11 ] [ 1.56659e-10 1.11428e-10 1.80298e-10 ] [ 1.14317e-12 2.78427e-10 2.63644e-10 ] [ 1.58247e-10 4.14354e-10 3.67768e-10 ] [ 2.87662e-10 -5.800460000000001e-12 2.88139e-10 ] [ 4.22527e-10 1.43863e-10 4.17233e-10 ] [ 2.56962e-10 2.98931e-10 1.05287e-11 ] [ 4.067179999999999e-10 4.1162e-10 1.17836e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.2250916 4.8204611 -7.7007575 ] [ -1.5007231 1.2384778 -4.9163773 ] [ -1.8327936 0.0475253 0.2534036 ] [ -1.2047439 -2.0200057 8.4313794 ] [ 5.4446607 -0.4741586 2.6621526 ] [ 1.5936536 -0.695456 6.8680239 ] [ -5.8722947 -2.1764794 -5.7616491 ] [ 0.1471494 -0.7403644 0.1638244 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.167166361458465e-09 7.723230075895852e-09 -1.233797362895026e-08 ] [ -2.404423465114501e-09 1.984260176539819e-09 -7.876904769091828e-09 ] [ -2.936459056671867e-09 7.614392455650624e-11 4.059973235465549e-10 ] [ -1.930212510631413e-09 -3.236405906422739e-09 1.350855895577473e-08 ] [ 8.723308081728562e-09 -7.596858234712589e-10 4.265238656721935e-09 ] [ 2.553314539573755e-09 -1.114243343995085e-09 1.100378732367564e-08 ] [ -9.408453278787752e-09 -3.487104410332811e-09 -9.23117948527336e-09 ] [ 2.357593284447476e-10 -1.18619453255262e-09 2.624756235965875e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -198.76475 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.184562354891568e-17 } }