{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.423330000000001e-10 0.0 0.0 ] "source-value" [ 5.42333 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 7.07092e-12 5.40512e-10 0.0 ] "source-value" [ 0.0707092 5.40512 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -2.03562e-13 -7.26392e-12 5.50089e-10 ] "source-value" [ -0.00203562 -0.0726392 5.50089 ] } "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" [ [ -8.968508876782023e-10 4.14232671595129e-10 4.89270613630297e-10 ] [ 4.132539018974823e-10 1.924540965611443e-10 -1.352314773521309e-09 ] [ 3.506733637420205e-10 1.65933427174704e-10 -3.453015859678023e-10 ] [ 9.197724275036776e-10 1.8647333145336e-10 8.950841675184461e-10 ] [ -6.940707627960019e-10 -4.225255377843898e-10 1.072085270571974e-10 ] [ 4.884576692129031e-10 -3.292264672783296e-10 1.519986882764905e-09 ] [ -1.694018191234118e-10 2.491626574013741e-10 8.207066426863718e-10 ] [ -4.118340529761293e-10 -4.56504179122992e-10 -2.134640153732782e-09 ] ] "source-value" [ [ -0.5597703 0.2585437 0.3053787 ] [ 0.2579328 0.1201204 -0.8440485 ] [ 0.2188731 0.1035675 -0.2155203 ] [ 0.5740768 0.1163875 0.5586676 ] [ -0.4332049 -0.2637197 0.0669143 ] [ 0.3048713 -0.205487 0.9487012 ] [ -0.1057323 0.1555151 0.5122448 ] [ -0.2570466 -0.2849275 -1.3323376 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -5.42909e-13 2.77818e-12 -3.88963e-12 ] [ 1.35422e-10 1.36306e-10 1.38504e-10 ] [ 2.97601e-12 2.72434e-10 2.72311e-10 ] [ 1.36125e-10 4.06894e-10 4.03995e-10 ] [ 2.72846e-10 9.23744e-13 2.71344e-10 ] [ 4.08711e-10 1.36473e-10 3.96445e-10 ] [ 2.72619e-10 2.69674e-10 -1.00972e-11 ] [ 4.11061e-10 4.07011e-10 1.39355e-10 ] ] "source-value" [ [ -0.00542909 0.0277818 -0.0388963 ] [ 1.35422 1.36306 1.38504 ] [ 0.0297601 2.72434 2.72311 ] [ 1.36125 4.06894 4.03995 ] [ 2.72846 0.00923744 2.71344 ] [ 4.08711 1.36473 3.96445 ] [ 2.72619 2.69674 -0.100972 ] [ 4.11061 4.07011 1.39355 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 2.423769106940013e-17 "source-value" 151.27977 } }