{ "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" [ 5.45189 0 0 ] "si-unit" "m" "si-value" [ 5.451889999999999e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.103872 5.48254 0 ] "si-unit" "m" "si-value" [ 1.03872e-11 5.482540000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0133572 0.0848103 5.46172 ] "si-unit" "m" "si-value" [ -1.33572e-12 8.481030000000001e-12 5.46172e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0515087 0.139447 0.129479 ] [ 1.28089 1.29793 1.3896 ] [ -0.0267641 2.78569 2.67144 ] [ 1.28772 4.21003 3.97686 ] [ 2.71226 0.0930415 2.84614 ] [ 4.11731 1.46571 4.11351 ] [ 2.72029 2.73709 -0.0733662 ] [ 4.08924 4.18171 1.22387 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.15087e-12 1.39447e-11 1.29479e-11 ] [ 1.28089e-10 1.29793e-10 1.3896e-10 ] [ -2.67641e-12 2.78569e-10 2.67144e-10 ] [ 1.28772e-10 4.21003e-10 3.97686e-10 ] [ 2.71226e-10 9.304150000000001e-12 2.84614e-10 ] [ 4.11731e-10 1.46571e-10 4.11351e-10 ] [ 2.72029e-10 2.73709e-10 -7.336620000000001e-12 ] [ 4.089240000000001e-10 4.18171e-10 1.22387e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.371759 -2.9925337 -3.3316315 ] [ 2.9098552 3.1058868 1.5877404 ] [ -0.2706645 0.237273 -0.2661139 ] [ 0.5961708 0.0468368 1.5651226 ] [ 0.0821179 -0.6265976 -1.4701517 ] [ -0.089966 0.0564625 0.0439539 ] [ -0.7671048 0.1838613 0.4797656 ] [ -0.0886496 -0.011189 1.3913145 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.799976819971987e-09 -4.794567531096121e-09 -5.337862098420835e-09 ] [ 4.662101971353309e-09 4.976179217811326e-09 2.54384054877964e-09 ] [ -4.336523339805216e-10 3.801532533470784e-10 -4.263614690499091e-10 ] [ 9.551709177636327e-10 7.504082595308544e-11 2.50760283840571e-09 ] [ 1.315673795291923e-10 -1.00392002536939e-09 -2.355442682769375e-09 ] [ -1.441414218668928e-10 9.046289745192e-11 7.042191097298111e-11 ] [ -1.22903737626346e-09 2.94578276329895e-10 7.686692277840844e-10 ] [ -1.420323165632717e-10 -1.79267542101312e-11 2.229131564080042e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.054372 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.776547189602614e-18 } }