{ "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" [ 5.51526 0 0 ] "si-unit" "m" "si-value" [ 5.51526e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0933018 5.35906 0 ] "si-unit" "m" "si-value" [ -9.33018e-12 5.35906e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.235006 -0.443739 5.60819 ] "si-unit" "m" "si-value" [ 2.35006e-11 -4.43739e-11 5.60819e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0139599 -0.0171452 -0.258284 ] [ 1.4668 1.50235 1.27166 ] [ -0.150248 2.65293 3.01531 ] [ 1.35939 3.8116 4.44507 ] [ 2.6266 -0.11212 2.88055 ] [ 3.83653 1.13315 3.7283 ] [ 2.72617 2.6833 0.230289 ] [ 3.93014 4.1583 1.51189 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.39599e-12 -1.71452e-12 -2.58284e-11 ] [ 1.4668e-10 1.50235e-10 1.27166e-10 ] [ -1.50248e-11 2.65293e-10 3.01531e-10 ] [ 1.35939e-10 3.8116e-10 4.44507e-10 ] [ 2.6266e-10 -1.1212e-11 2.88055e-10 ] [ 3.83653e-10 1.13315e-10 3.7283e-10 ] [ 2.72617e-10 2.6833e-10 2.30289e-11 ] [ 3.930140000000001e-10 4.1583e-10 1.51189e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -13.9177125 13.8666195 13.7714905 ] [ -8.5529909 -8.5668346 6.1044603 ] [ 1.2705914 0.4014027 -1.7788388 ] [ 15.6247992 -13.7152657 -10.3780537 ] [ -11.0687284 -7.866806 -6.1159259 ] [ 8.3732867 9.6818266 8.8064073 ] [ 5.328478 6.1885716 -8.96994 ] [ 2.9422765 0.010485900000000015 -1.4395997 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.229863358251592e-08 2.221677357242939e-08 2.20643601126693e-08 ] [ -1.370340205789515e-08 -1.372558211038052e-08 9.780423575261756e-09 ] [ 2.035711835669541e-09 6.431180214659961e-10 -2.850013937531927e-09 ] [ 2.503368798293454e-08 -2.197427805260015e-08 -1.662747500754694e-08 ] [ -1.773405786446499e-08 -1.260401265356917e-08 -9.798793491525198e-09 ] [ 1.341548418999558e-08 1.551199622515955e-08 1.410941988930245e-08 ] [ 8.537162876047142e-09 9.91518473366685e-09 -1.437142815797875e-08 ] [ 4.714046620229251e-09 1.680026382804674e-11 -2.306492982650694e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -27.675701 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.434136110645119e-18 } }