{ "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" [ 5.42333 0 0 ] "si-unit" "m" "si-value" [ 5.423330000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0707092 5.40512 0 ] "si-unit" "m" "si-value" [ 7.07092e-12 5.40512e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.00203562 -0.0726392 5.50089 ] "si-unit" "m" "si-value" [ -2.03562e-13 -7.26392e-12 5.50089e-10 ] } "unrelaxed-configuration-positions" { "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 ] ] "source-unit" "angstrom" "si-unit" "m" "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 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.1940975 0.5448389 0.6242252 ] [ 0.5383276 0.2599053 -1.7047442 ] [ 0.4194028 0.1716525 -0.3981583 ] [ 1.2187018 0.2262284 1.0198853 ] [ -0.9328783 -0.5487049 0.1905192 ] [ 0.6733291 -0.4317176 1.8815199 ] [ -0.2397912 0.3546825 1.1069685 ] [ -0.4829944 -0.5768851 -2.7202157 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.913155113217815e-09 8.729281548742625e-10 1.000119029793977e-09 ] [ 8.624959021572983e-10 4.164141987127601e-10 -2.731301324187022e-09 ] [ 6.719573663941752e-10 2.75017624667685e-10 -6.379199248931622e-10 ] [ 1.952575547773741e-09 3.624578564272056e-10 1.63403639702008e-09 ] [ -1.494635814625642e-09 -8.791221697413066e-10 3.052454105683728e-10 ] [ 1.078792151012249e-09 -6.916878512065583e-10 3.014527220186016e-09 ] [ -3.841878576788207e-10 5.68264013988705e-10 1.773559065274029e-09 ] [ -7.738423420328495e-10 -9.242718277227533e-10 -4.358266033979953e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -327.98626 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.254919220450489e-17 } }