{ "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" [ [ 2.0596457 -0.6643245 0.6497134 ] [ -0.5957506 2.4636913 -0.0562206 ] [ 0.2045553 -0.6523802 -1.1409821 ] [ -0.5916151 -0.9819152 -1.1328152 ] [ 0.7239457 -0.7437363 -0.4049995 ] [ -1.8422759 2.6357302 -1.0081733 ] [ 0.7176761 -1.1130754 0.3958948 ] [ -0.6761813 -0.9439899 2.6975824 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.299916187671251e-09 -1.06436518252465e-09 1.040955619700479e-09 ] [ -9.544976831475725e-10 3.947268601728358e-09 -9.007533092734848e-11 ] [ 3.277337193207302e-10 -1.045228304312828e-09 -1.828054845371288e-09 ] [ -9.47871881732254e-10 -1.573201577048156e-09 -1.814970029126876e-09 ] [ 1.159888875268691e-09 -1.191596911900295e-09 -6.488807303356897e-10 ] [ -2.951651376043279e-09 4.222905305176507e-09 -1.615271690974785e-09 ] [ 1.149843868726923e-09 -1.783343383067608e-09 6.342933928562918e-10 ] [ -1.083361870282151e-09 -1.51243854805133e-09 4.322003453961554e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.028313 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.772372077546471e-18 } }