{ "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" [ 5.42356 0 0 ] "si-unit" "m" "si-value" [ 5.42356e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0141122 5.36968 0 ] "si-unit" "m" "si-value" [ 1.41122e-12 5.36968e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.125956 0.0899535 5.38067 ] "si-unit" "m" "si-value" [ -1.25956e-11 8.99535e-12 5.380670000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0132742 0.0797855 -0.0480858 ] [ 1.38077 1.28242 1.3281 ] [ 0.0139699 2.87381 2.72647 ] [ 1.34708 4.2887 4.09361 ] [ 2.73598 0.0766444 2.67003 ] [ 4.1072 1.37855 3.98819 ] [ 2.71459 2.70679 -0.0921964 ] [ 4.08895 4.12737 1.11939 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.32742e-12 7.97855e-12 -4.80858e-12 ] [ 1.38077e-10 1.28242e-10 1.3281e-10 ] [ 1.39699e-12 2.873810000000001e-10 2.72647e-10 ] [ 1.34708e-10 4.2887e-10 4.09361e-10 ] [ 2.73598e-10 7.66444e-12 2.67003e-10 ] [ 4.1072e-10 1.37855e-10 3.98819e-10 ] [ 2.71459e-10 2.70679e-10 -9.21964e-12 ] [ 4.08895e-10 4.12737e-10 1.11939e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.7284615 -0.4901498 0.6673121 ] [ -0.5015976 2.0380489 0.070723 ] [ 0.2329923 -0.5774829 -1.0048996 ] [ -0.4206784 -0.7358381 -0.8291097 ] [ 0.6111484 -0.6595533 -0.4085035 ] [ -1.5387666 2.2611554 -0.9604978 ] [ 0.5267719 -0.9565673 0.2735125 ] [ -0.6383316 -0.8796128 2.191463 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.769300605252899e-09 -7.853065502497959e-10 1.069151845396952e-09 ] [ -8.036479477693901e-10 3.265314299627157e-09 1.133107371528384e-10 ] [ 3.732948158864198e-10 -9.252296012917844e-10 -1.610026645371271e-09 ] [ -6.740010973555507e-10 -1.178942600513893e-09 -1.328380177418502e-09 ] [ 9.791676783193268e-10 -1.056720877431489e-09 -6.544947572149728e-10 ] [ -2.465375871387905e-09 3.622770317875672e-09 -1.538887119489834e-09 ] [ 8.439816226743955e-10 -1.53258976428178e-09 4.3821533299656e-10 ] [ -1.022719965837857e-09 -1.409295063516426e-09 3.511110783948231e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.221648 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.803347759244709e-18 } }