{ "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" [ [ -10.5274559 9.2575123 5.8499206 ] [ -7.8051445 -3.4478206 2.9809596 ] [ 1.7727362 -0.19335819999999998 -2.4748162 ] [ 7.760829 -7.9216839 -2.0614922 ] [ -9.03472 -4.2604177 -2.7480784 ] [ 6.6209355 3.5156191 5.7231687 ] [ 4.9147186 1.9533119 -4.6385878 ] [ 6.2981012 1.0968371 -2.6310742 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.686684385844544e-08 1.48321698960276e-08 9.37260609607526e-09 ] [ -1.250522014289361e-08 -5.524017603543859e-09 4.776023818017986e-09 ] [ 2.840236517885951e-09 -3.097939900322987e-10 -3.96509268908467e-09 ] [ 1.243421888426959e-08 -1.269193684651399e-08 -3.302874634013254e-09 ] [ -1.447521727873248e-08 -6.82594169002002e-09 -4.402907000880105e-09 ] [ 1.06079081533211e-08 5.632642776064109e-09 9.169527163580154e-09 ] [ 7.87424730360519e-09 3.129550685094145e-09 -7.431836987917464e-09 ] [ 1.009067058120736e-08 1.757326772924321e-09 -4.215445605560243e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -317.95814 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.094251024981007e-17 } }