{ "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" [ [ 1.7974557 -0.528264 0.6695014 ] [ -0.5324168 2.4756497 0.2067949 ] [ 0.2727801 -0.6345935 -1.1551541 ] [ -0.423415 -0.8716825 -1.0204819 ] [ 0.7971545 -0.8210029 -0.5643225 ] [ -1.7076563 2.6665278 -1.0297138 ] [ 0.6275016 -1.28479 0.3159085 ] [ -0.831404 -1.0018445 2.5774674 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.879841499463699e-09 -8.463722304102911e-10 1.072659490672869e-09 ] [ -8.530257494811495e-10 3.966428070630534e-09 3.313219540806739e-10 ] [ 4.370418988394862e-10 -1.016730869411645e-09 -1.850760892441266e-09 ] [ -6.78385613896032e-10 -1.396589322260496e-09 -1.634992242129564e-09 ] [ 1.277182303065514e-09 -1.315391651989e-09 -9.041443160914079e-10 ] [ -2.735967000221831e-09 4.272248499873259e-09 -1.649783376475127e-09 ] [ 1.005368393034593e-09 -2.058460500637632e-09 5.061412130119968e-10 ] [ -1.332056051239603e-09 -1.605131835577066e-09 4.129558009154162e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.863066 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.745896589540738e-18 } }