{ "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" [ 5.43808 0 0 ] "si-unit" "m" "si-value" [ 5.438080000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.036104 5.43472 0 ] "si-unit" "m" "si-value" [ -3.6104e-12 5.434720000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0778792 -0.0548884 5.50823 ] "si-unit" "m" "si-value" [ 7.78792e-12 -5.48884e-12 5.50823e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0442028 -0.0162787 0.186746 ] [ 1.46625 1.46109 1.35616 ] [ 0.0256733 2.72542 2.65757 ] [ 1.37985 4.00669 4.1027 ] [ 2.74744 0.0130417 2.60748 ] [ 4.13581 1.33996 3.97093 ] [ 2.70334 2.70384 0.0742117 ] [ 4.06803 4.03744 1.33105 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.42028e-12 -1.62787e-12 1.86746e-11 ] [ 1.46625e-10 1.46109e-10 1.35616e-10 ] [ 2.56733e-12 2.72542e-10 2.65757e-10 ] [ 1.37985e-10 4.00669e-10 4.1027e-10 ] [ 2.74744e-10 1.30417e-12 2.60748e-10 ] [ 4.13581e-10 1.33996e-10 3.97093e-10 ] [ 2.70334e-10 2.70384e-10 7.42117e-12 ] [ 4.068030000000001e-10 4.03744e-10 1.33105e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.8953852 4.9565404 -8.3366911 ] [ -2.0735525 -1.9342033 0.6941754 ] [ 0.1431179 0.1130766 0.6072789 ] [ -0.2621495 1.2455672 0.9413455 ] [ -0.0147383 -0.688839 1.4164612 ] [ 3.6654355 -4.3374013 6.5437192 ] [ 1.043525 0.9396928 -3.0880396 ] [ -0.6062529 -0.2944334 1.2217505 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.036741879869416e-09 7.941253214357013e-09 -1.335685168529576e-08 ] [ -3.322197364872284e-09 -3.098935332665692e-09 1.112191605777603e-09 ] [ 2.293001552871486e-10 1.811686863721644e-10 9.729680639012225e-10 ] [ -4.200098035147829e-10 1.995618663916804e-09 1.508201764621047e-09 ] [ -2.36133598848822e-11 -1.103641750387926e-09 2.269421037607601e-09 ] [ 5.872675111534106e-09 -6.949283015141223e-09 1.048419400169717e-08 ] [ 1.67191137199485e-09 1.505553847298035e-09 -4.947584891986706e-09 ] [ -9.713242306747384e-10 -4.717343137491756e-10 1.957460103677817e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.571315 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.699152973365371e-18 } }