{ "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" [ [ -1.004566984288869e-09 7.665208691532537e-10 2.114873139456e-10 ] [ 5.242816975833427e-10 1.010284511777856e-10 -1.510211202113094e-09 ] [ 4.387913154917376e-11 3.161831474083968e-11 -6.774420920840429e-10 ] [ 1.476906756696524e-09 -4.025302133391437e-10 7.324691685607431e-10 ] [ -1.314484659803965e-09 -2.409149725928199e-10 -4.738709726041536e-11 ] [ 4.519730634217075e-10 -8.208609322949549e-10 2.496014935778112e-09 ] [ -1.933574037399514e-10 1.002239982964819e-09 1.104127361029016e-09 ] [ 1.536855879969984e-11 -4.371013395921177e-10 -2.309058548073581e-09 ] ] "source-value" [ [ -0.6270014 0.4784247 0.132 ] [ 0.3272309 0.063057 -0.9425997 ] [ 0.0273872 0.0197346 -0.4228261 ] [ 0.9218127 -0.2512396 0.4571713 ] [ -0.8204368 -0.1503673 -0.0295767 ] [ 0.2820994 -0.5123411 1.55789 ] [ -0.1206842 0.625549 0.6891421 ] [ 0.0095923 -0.2728172 -1.441201 ] ] } "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" -5.888908316672304e-18 "source-value" -36.755675 } }