{ "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" [ 5.05932 0 0 ] "si-unit" "m" "si-value" [ 5.059319999999999e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.224512 5.44129 0 ] "si-unit" "m" "si-value" [ 2.24512e-11 5.441290000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.327401 0.688972 5.24092 ] "si-unit" "m" "si-value" [ 3.27401e-11 6.88972e-11 5.24092e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.119472 0.0796179 0.152764 ] [ 1.48092 1.5486 0.772169 ] [ 0.0612704 2.84226 2.7863 ] [ 1.84412 4.4971 3.9905 ] [ 2.88701 0.305191 2.51679 ] [ 4.25223 1.88781 3.92663 ] [ 2.58737 2.78734 -0.624797 ] [ 3.988 4.24006 0.48768 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.19472e-11 7.96179e-12 1.52764e-11 ] [ 1.48092e-10 1.5486e-10 7.72169e-11 ] [ 6.127040000000001e-12 2.84226e-10 2.786300000000001e-10 ] [ 1.84412e-10 4.4971e-10 3.9905e-10 ] [ 2.88701e-10 3.05191e-11 2.51679e-10 ] [ 4.25223e-10 1.88781e-10 3.92663e-10 ] [ 2.58737e-10 2.78734e-10 -6.247970000000001e-11 ] [ 3.988e-10 4.24006e-10 4.8768e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 16.7457967 13.3255525 -4.5739512 ] [ -0.5580396 -1.6307693 5.8441791 ] [ 16.0420164 16.6868496 -21.0487046 ] [ -31.0146235 28.3696975 -19.489299 ] [ -0.0095553 1.1987288 -1.6660813 ] [ -15.4350896 -15.1175037 12.739654 ] [ 28.2570328 -25.2624122 18.4988995 ] [ -14.027538 -17.5701432 9.6953036 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.682972396940979e-08 2.134988867474299e-08 -7.328277677320105e-09 ] [ -8.940780006005836e-10 -2.612780446378381e-09 9.363407121787985e-09 ] [ 2.570214362657019e-08 2.673528030392583e-08 -3.372374240824542e-08 ] [ -4.969090467461426e-08 4.545326607366821e-08 -3.122529921358082e-08 ] [ -1.530927826473024e-11 1.920575258039639e-09 -2.669356507212071e-09 ] [ -2.472973969707322e-08 -2.42209109929975e-08 2.04111757958812e-08 ] [ 4.527275732533877e-08 -4.047484621185269e-08 2.963850428942881e-08 ] [ -2.247459343098359e-08 -2.81504726591481e-08 1.553358875947808e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -10.624778 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.702277091279018e-18 } }