{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.366440000000001e-10 0.0 0.0 ] "source-value" [ 5.36644 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -2.27231e-11 5.379480000000001e-10 0.0 ] "source-value" [ -0.227231 5.37948 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -3.50261e-12 -8.992650000000001e-12 5.399390000000001e-10 ] "source-value" [ -0.0350261 -0.0899265 5.39939 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -3.488617826368819e-10 4.160037176317613e-10 -3.951685322018918e-10 ] [ -8.648325094351488e-11 2.122959324861178e-10 -3.169489878331392e-11 ] [ 3.2722454759064e-10 2.516362578862272e-10 -3.894045415909017e-10 ] [ 1.918992627973613e-10 3.684400605077337e-10 -5.098904665223309e-10 ] [ -1.049276684198266e-10 -3.390112803368794e-10 1.460714038243085e-10 ] [ -3.580957673732007e-10 -2.210468609712653e-10 6.605705313963706e-10 ] [ 4.830637814013178e-10 -2.957856766313299e-10 1.993976096003674e-10 ] [ -1.038191224158951e-10 -3.925321505723655e-10 3.20118894277392e-10 ] ] "source-value" [ [ -0.2177424 0.2596491 -0.2466448 ] [ -0.0539786 0.1325047 -0.0197824 ] [ 0.2042375 0.157059 -0.2430472 ] [ 0.1197741 0.2299622 -0.3182486 ] [ -0.0654907 -0.2115942 0.0911706 ] [ -0.2235058 -0.1379666 0.4122957 ] [ 0.3015047 -0.1846149 0.1244542 ] [ -0.0647988 -0.2449993 0.1998025 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -1.04229e-13 7.7963e-13 2.24549e-13 ] [ 1.32493e-10 1.37357e-10 1.36608e-10 ] [ -9.58533e-12 2.66355e-10 2.80902e-10 ] [ 1.19786e-10 4.07015e-10 4.22336e-10 ] [ 2.70129e-10 1.13781e-11 2.60003e-10 ] [ 3.9906e-10 1.45175e-10 3.98519e-10 ] [ 2.48193e-10 2.86985e-10 1.62227e-13 ] [ 4.00824e-10 4.16333e-10 1.43322e-10 ] ] "source-value" [ [ -0.00104229 0.0077963 0.00224549 ] [ 1.32493 1.37357 1.36608 ] [ -0.0958533 2.66355 2.80902 ] [ 1.19786 4.07015 4.22336 ] [ 2.70129 0.113781 2.60003 ] [ 3.9906 1.45175 3.98519 ] [ 2.48193 2.86985 0.00162227 ] [ 4.00824 4.16333 1.43322 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 5.09564727993556e-18 "source-value" 31.804529 } }