{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.5048e-10 0.0 0.0 ] "source-value" [ 5.5048 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.92448e-12 5.36034e-10 0.0 ] "source-value" [ 0.0192448 5.36034 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.90348e-11 1.57222e-12 5.58687e-10 ] "source-value" [ 0.190348 0.0157222 5.58687 ] } "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" [ [ 2.51706032678063e-09 4.811330303991241e-09 -3.602757529705259e-09 ] [ -1.358879211572051e-09 1.974706237132326e-09 -3.808089761726732e-09 ] [ -4.493286068220123e-09 -4.523112188192937e-09 -3.155880669678993e-09 ] [ 1.293681037253526e-09 -1.304861346148792e-09 6.420721526114703e-09 ] [ 3.933398398504432e-09 7.490890273012876e-10 6.732153899407105e-10 ] [ 3.364428630396074e-09 7.877966531538433e-11 -7.699421571093101e-10 ] [ -2.465167908862525e-09 1.497236295184869e-09 5.264358240500084e-10 ] [ -2.791235204279962e-09 -3.283168154801042e-09 3.716297378114873e-09 ] ] "source-value" [ [ 1.5710255 3.0029962 -2.2486644 ] [ -0.8481457 1.2325147 -2.3768227 ] [ -2.8044886 -2.8231046 -1.9697458 ] [ 0.8074522 -0.8144304 4.0074992 ] [ 2.4550342 0.4675446 0.420188 ] [ 2.0999112 0.0491704 -0.4805601 ] [ -1.5386368 0.9345014 0.3285754 ] [ -1.742152 -2.0491924 2.3195304 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -1.13409e-12 -6.87251e-12 -7.641280000000001e-12 ] [ 1.39555e-10 1.34846e-10 1.39039e-10 ] [ 1.52538e-11 2.8802e-10 2.74744e-10 ] [ 1.52254e-10 4.15487e-10 3.864390000000001e-10 ] [ 2.76536e-10 1.71046e-12 2.52424e-10 ] [ 4.13989e-10 1.28016e-10 4.0502e-10 ] [ 2.78466e-10 2.66896e-10 -1.7742e-11 ] [ 4.2307e-10 4.058290000000001e-10 1.13615e-10 ] ] "source-value" [ [ -0.0113409 -0.0687251 -0.0764128 ] [ 1.39555 1.34846 1.39039 ] [ 0.152538 2.8802 2.74744 ] [ 1.52254 4.15487 3.86439 ] [ 2.76536 0.0171046 2.52424 ] [ 4.13989 1.28016 4.0502 ] [ 2.78466 2.66896 -0.17742 ] [ 4.2307 4.05829 1.13615 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.649896089034346e-18 "source-value" -35.263878 } }