{ "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" [ 5.29616 0 0 ] "si-unit" "m" "si-value" [ 5.29616e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.242438 5.47618 0 ] "si-unit" "m" "si-value" [ -2.42438e-11 5.47618e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.11809 -0.0034447 5.45685 ] "si-unit" "m" "si-value" [ 1.1809e-11 -3.4447e-13 5.456850000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0183909 -0.0832388 -0.0590634 ] [ 1.37993 1.35458 1.33752 ] [ -0.123201 2.75975 2.68859 ] [ 1.45379 4.06883 4.12913 ] [ 2.80695 0.0674874 2.75473 ] [ 4.11558 1.36445 4.01895 ] [ 2.83757 2.84317 -0.0421665 ] [ 3.94058 4.22423 1.31424 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.83909e-12 -8.32388e-12 -5.90634e-12 ] [ 1.37993e-10 1.35458e-10 1.33752e-10 ] [ -1.23201e-11 2.75975e-10 2.68859e-10 ] [ 1.45379e-10 4.06883e-10 4.12913e-10 ] [ 2.80695e-10 6.748740000000001e-12 2.75473e-10 ] [ 4.11558e-10 1.36445e-10 4.01895e-10 ] [ 2.83757e-10 2.84317e-10 -4.21665e-12 ] [ 3.94058e-10 4.224230000000001e-10 1.31424e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.4100743 2.8548574 -1.854789 ] [ -0.1712155 0.8474881 -0.2132679 ] [ 3.6081148 1.0196316 -1.1371089 ] [ -2.0512815 -0.1109154 -0.5640471 ] [ -0.6700501 -0.6794326 -1.7341573 ] [ -0.1387021 -0.414224 2.2285753 ] [ -2.5325802 -2.130508 0.0103051 ] [ -1.4543597 -1.3868971 3.2644897 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.463541318650926e-09 4.573985781997875e-09 -2.971699572317011e-09 ] [ -2.743174712185824e-10 1.357825620226213e-09 -3.416928433471123e-10 ] [ 5.780837177722468e-09 1.633629911348898e-09 -1.821849294883605e-09 ] [ -3.286515261979556e-09 -1.777060607666803e-10 -9.037030766500398e-10 ] [ -1.073538604984702e-09 -1.088571027129358e-09 -2.778426282849652e-09 ] [ -2.222252618758637e-10 -6.636600085742592e-10 3.570571243352346e-09 ] [ -4.057640786740988e-09 -3.413450108027366e-09 1.651059029500608e-11 ] [ -2.330141109573702e-09 -2.22205410907532e-09 5.230289076182405e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.546784 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.695222626942751e-18 } }