{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.49393e-10 0.0 0.0 ] "source-value" [ 5.49393 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 2.595e-13 5.45604e-10 0.0 ] "source-value" [ 0.002595 5.45604 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -6.981170000000001e-12 7.48179e-12 5.57684e-10 ] "source-value" [ -0.0698117 0.0748179 5.57684 ] } "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" [ [ 1.222816925533204e-09 -9.021903014846803e-10 -3.022364722943583e-09 ] [ -3.80661303553534e-09 -2.775921600138356e-10 3.044987937482265e-09 ] [ 1.442116612899487e-09 5.508116595941837e-10 -2.933871381211613e-09 ] [ -2.647269701406033e-09 3.804653573528102e-09 -1.241891639292138e-09 ] [ 7.749632184212353e-11 -1.461710752318885e-09 2.56181264458814e-09 ] [ -1.941566815907698e-09 -1.484214764916979e-10 3.403004557330399e-09 ] [ 5.271106768644555e-09 -2.807760053946893e-10 -2.703185184818967e-09 ] [ 3.819132443650272e-10 -1.284774697636161e-09 8.915079490831584e-10 ] ] "source-value" [ [ 0.7632223 -0.5631029 -1.8864117 ] [ -2.375901 -0.1732594 1.900532 ] [ 0.9000984 0.3437896 -1.8311785 ] [ -1.6522958 2.374678 -0.7751278 ] [ 0.0483694 -0.9123281 1.5989577 ] [ -1.2118307 -0.0926374 2.1239884 ] [ 3.2899661 -0.1752466 -1.6871955 ] [ 0.2383715 -0.8018933 0.5564355 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -5.683470000000001e-12 2.59582e-14 3.66732e-12 ] [ 1.4042e-10 1.34788e-10 1.25876e-10 ] [ -1.16956e-12 2.70772e-10 2.89683e-10 ] [ 1.4664e-10 4.01047e-10 4.21293e-10 ] [ 2.72042e-10 4.65962e-12 2.583750000000001e-10 ] [ 4.04434e-10 1.40284e-10 4.02526e-10 ] [ 2.59741e-10 2.72967e-10 1.38309e-11 ] [ 4.11134e-10 4.10597e-10 1.37335e-10 ] ] "source-value" [ [ -0.0568347 0.000259582 0.0366732 ] [ 1.4042 1.34788 1.25876 ] [ -0.0116956 2.70772 2.89683 ] [ 1.4664 4.01047 4.21293 ] [ 2.72042 0.0465962 2.58375 ] [ 4.04434 1.40284 4.02526 ] [ 2.59741 2.72967 0.138309 ] [ 4.11134 4.10597 1.37335 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -6.520606984491211e-18 "source-value" -40.698428 } }