{ "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" [ 5.47613 0 0 ] "si-unit" "m" "si-value" [ 5.476130000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0968569 5.44973 0 ] "si-unit" "m" "si-value" [ -9.68569e-12 5.44973e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0334568 0.0277585 5.60527 ] "si-unit" "m" "si-value" [ -3.34568e-12 2.77585e-12 5.60527e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.000509808 0.0158858 0.00549688 ] [ 1.34999 1.33014 1.19729 ] [ 0.0276425 2.69054 2.64154 ] [ 1.36667 4.13087 4.06954 ] [ 2.77416 0.0351576 2.5647 ] [ 4.07457 1.31666 4.03649 ] [ 2.84869 2.60665 0.046702 ] [ 4.10529 4.27129 1.35792 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.098080000000001e-14 1.58858e-12 5.49688e-13 ] [ 1.34999e-10 1.33014e-10 1.19729e-10 ] [ 2.76425e-12 2.69054e-10 2.64154e-10 ] [ 1.36667e-10 4.13087e-10 4.06954e-10 ] [ 2.77416e-10 3.51576e-12 2.5647e-10 ] [ 4.07457e-10 1.31666e-10 4.03649e-10 ] [ 2.84869e-10 2.60665e-10 4.6702e-12 ] [ 4.10529e-10 4.27129e-10 1.35792e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.7395698 -0.0921362 -3.8764778 ] [ 0.6273249 0.7377173 2.1433225 ] [ -0.4574294 0.914632 0.5178496 ] [ -0.08676 -0.8142276 0.9160446 ] [ -1.3413959 0.4402167 1.7873054 ] [ 0.7547352 0.7014411 0.8544189 ] [ -0.221227 2.0608635 -2.3806364 ] [ -0.0148178 -3.9485067 0.0381731 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.184921452772053e-09 -1.476184667855508e-10 -6.210802153379724e-09 ] [ 1.005085296706386e-09 1.181953420557568e-09 3.433981228626465e-09 ] [ -7.328826963846395e-10 1.465402019108688e-09 8.296865290462463e-10 ] [ -1.3900484476584e-10 -1.304536435477898e-09 1.467665253821876e-09 ] [ -2.1491531679234e-09 7.053049106365877e-10 2.863578949702023e-09 ] [ 1.209219102297317e-09 1.123832540547257e-09 1.368929997227982e-09 ] [ -3.54444730209918e-10 3.301867345563459e-09 -3.814200014129878e-09 ] [ -2.37407329272852e-11 -6.326205173932448e-09 6.11600488673454e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -35.546217 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.695131830449357e-18 } }