{ "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" [ 5.36644 0 0 ] "si-unit" "m" "si-value" [ 5.366440000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.227231 5.37948 0 ] "si-unit" "m" "si-value" [ -2.27231e-11 5.379480000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0350261 -0.0899265 5.39939 ] "si-unit" "m" "si-value" [ -3.50261e-12 -8.992650000000001e-12 5.399390000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00104229 0.0077963 0.00224549 ] [ 1.32493 1.37357 1.36608 ] [ -0.0958533 2.66355 2.80902 ] [ 1.19786 4.07015 4.22336 ] [ 2.70129 0.113781 2.60003 ] [ 3.9906 1.45175 3.98519 ] [ 2.48193 2.86985 0.00162227 ] [ 4.00824 4.16333 1.43322 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.04229e-13 7.7963e-13 2.24549e-13 ] [ 1.32493e-10 1.37357e-10 1.36608e-10 ] [ -9.58533e-12 2.66355e-10 2.80902e-10 ] [ 1.19786e-10 4.07015e-10 4.22336e-10 ] [ 2.70129e-10 1.13781e-11 2.60003e-10 ] [ 3.9906e-10 1.45175e-10 3.98519e-10 ] [ 2.48193e-10 2.86985e-10 1.62227e-13 ] [ 4.00824e-10 4.16333e-10 1.43322e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.232937 2.5530497 -0.7231016 ] [ -1.1411755 1.0379851 -0.3803261 ] [ 2.233731 2.4829122 -2.3527445 ] [ -0.339085 1.6169948 -4.0057817 ] [ -0.1704887 -1.8573944 2.3026056 ] [ -2.0607692 -2.1217175 3.1090586 ] [ 3.2102796 -1.7912131 1.5761681 ] [ -1.9654291 -1.9206167 0.4741215 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.73206218594058e-10 4.090436574780709e-09 -1.158536487528014e-09 ] [ -1.828364721393267e-09 1.663035473660153e-09 -6.093495907203473e-10 ] [ 3.578831614841454e-09 3.978063911113534e-09 -3.769512263672013e-09 ] [ -5.4327406393989e-10 2.590711285859503e-09 -6.417969840644797e-09 ] [ -2.731530115010358e-10 -2.975873907802449e-09 3.68918088963755e-09 ] [ -3.301716260306873e-09 -3.399366202448894e-09 4.981261042656752e-09 ] [ 5.143434963726865e-09 -2.869839775334705e-09 2.525299701076175e-09 ] [ -3.148964579803649e-09 -3.077167199610187e-09 7.596263889770308e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -35.584094 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.701200394885959e-18 } }