{ "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" [ [ 1.4974 1.7675638 -3.4066497 ] [ -2.2032844 -2.1916753 0.9885358 ] [ 0.1732939 0.0638098 0.7091816 ] [ -0.0019719 0.947847 0.4216128 ] [ 0.1635368 -0.6981069 1.5754854 ] [ -0.1392422 -0.6500662 1.692205 ] [ 1.2331001 1.1311181 -3.4769778 ] [ -0.7228322 -0.3704905 1.496607 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.39909927198592e-09 2.831949396132407e-09 -5.458054504595334e-09 ] [ -3.530050754653355e-09 -3.511450926044826e-09 1.583808947583824e-09 ] [ 2.776474351072531e-10 1.022345697379238e-10 1.136234179421537e-09 ] [ -3.15933207855552e-12 1.518618303495417e-09 6.754981711900263e-10 ] [ 2.620148376004455e-10 -1.118490553999164e-09 2.524205874291737e-09 ] [ -2.230905974687578e-10 -1.041520867612297e-09 2.711211288600864e-09 ] [ 1.975644151326142e-09 1.812250975183716e-09 -5.570732542200618e-09 ] [ -1.15810485160143e-09 -5.935912173285024e-10 2.397828745925626e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.870975 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.747163751030128e-18 } }