{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-periodic-cell-vector-1" { "source-unit" "angstrom" "source-value" [ 5.23298 0 0 ] "si-unit" "m" "si-value" [ 5.23298e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.924429 5.53043 0 ] "si-unit" "m" "si-value" [ -9.24429e-11 5.53043e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.629107 -0.473789 5.46851 ] "si-unit" "m" "si-value" [ -6.29107e-11 -4.73789e-11 5.46851e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.204863 0.0604192 -0.0594365 ] [ 1.57212 1.62558 1.26329 ] [ -0.456749 2.61396 2.82457 ] [ 0.563094 3.85296 4.15247 ] [ 2.57153 0.0726254 2.31215 ] [ 3.48703 1.34311 4.10214 ] [ 2.49706 2.93083 0.328276 ] [ 3.43659 4.115 1.72734 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.04863e-11 6.04192e-12 -5.94365e-12 ] [ 1.57212e-10 1.62558e-10 1.26329e-10 ] [ -4.56749e-11 2.61396e-10 2.82457e-10 ] [ 5.63094e-11 3.85296e-10 4.15247e-10 ] [ 2.57153e-10 7.262540000000001e-12 2.31215e-10 ] [ 3.48703e-10 1.34311e-10 4.102140000000001e-10 ] [ 2.49706e-10 2.93083e-10 3.28276e-11 ] [ 3.43659e-10 4.115e-10 1.72734e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.8694457 1.8932525 2.130338 ] [ -149.0137859 -146.2322759 108.0538058 ] [ -17.0156483 -26.5029995 -47.8593494 ] [ 29.6633336 33.3767873 41.1724345 ] [ 19.1394095 -23.349345 19.6687278 ] [ -10.9522304 -7.686346 12.0538069 ] [ 107.4938539 145.6916755 -159.0934565 ] [ 17.8156218 22.8092511 23.8736929 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.59735881519509e-09 3.033324892771152e-09 3.413177738001831e-09 ] [ -2.387464039458767e-07 -2.342899336533553e-07 1.731212814412235e-07 ] [ -2.726207389401526e-08 -4.24624861799741e-08 -7.66791306953785e-08 ] [ 4.752589958891111e-08 5.347550828947435e-08 6.596551197731934e-08 ] [ 3.066471443681742e-08 -3.740977466999338e-08 3.151277584203902e-08 ] [ -1.754740749249503e-08 -1.23148838605796e-08 1.931232760681772e-08 ] [ 1.722241395982709e-07 2.334237963312801e-07 -2.548958165265618e-07 ] [ 2.854377273297481e-08 3.654444885037669e-08 3.824987261653896e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 20.482363 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.281636313733895e-18 } }