{ "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" [ 5.45804 0 0 ] "si-unit" "m" "si-value" [ 5.45804e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0357167 5.39587 0 ] "si-unit" "m" "si-value" [ -3.57167e-12 5.395870000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.019829 -0.0610013 5.23355 ] "si-unit" "m" "si-value" [ 1.9829e-12 -6.10013e-12 5.23355e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0872055 -0.452445 -0.0713075 ] [ 1.44372 1.30265 0.852604 ] [ 0.0844836 2.96191 2.59679 ] [ 1.14061 3.90928 3.87091 ] [ 2.7873 -0.319613 3.1468 ] [ 4.07117 1.23968 4.05459 ] [ 2.72619 2.52806 0.379157 ] [ 3.92833 3.98172 1.55502 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.720550000000001e-12 -4.52445e-11 -7.13075e-12 ] [ 1.44372e-10 1.30265e-10 8.526040000000001e-11 ] [ 8.44836e-12 2.96191e-10 2.59679e-10 ] [ 1.14061e-10 3.90928e-10 3.87091e-10 ] [ 2.7873e-10 -3.19613e-11 3.1468e-10 ] [ 4.071170000000001e-10 1.23968e-10 4.05459e-10 ] [ 2.72619e-10 2.52806e-10 3.79157e-11 ] [ 3.92833e-10 3.98172e-10 1.55502e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.5470156 5.6380488 5.0082505 ] [ -6.817964 -5.6466278 6.1797698 ] [ -3.3580479 -8.2200396 -5.0091626 ] [ 6.8573151 -2.6673102 3.6762233 ] [ 1.227771 2.6233911 -3.6810694 ] [ 2.582464 1.3524761 0.8703313 ] [ 4.5717576 5.3049449 -5.9629308 ] [ 0.4837198 1.6151168 -1.0814121 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.887298709532886e-09 9.033149974289496e-09 8.02410186220991e-09 ] [ -1.092358252225605e-08 -9.046895047519339e-09 9.901082695485892e-09 ] [ -5.380185836906536e-09 -1.316995526917018e-08 -8.025563207505743e-09 ] [ 1.098662993467881e-08 -4.273502042861373e-09 5.889959024100225e-09 ] [ 1.967105991896237e-09 4.203135887634795e-09 -5.897723332222284e-09 ] [ 4.137563444857651e-09 2.166905587610763e-09 1.394424461210471e-09 ] [ 7.324763142684718e-09 8.499458693412194e-09 -9.55366831920824e-09 ] [ 7.750045545780518e-10 2.587702376821309e-09 -1.732613184070232e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -27.036644 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.33174789216926e-18 } }