{ "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" [ 5.41643 0 0 ] "si-unit" "m" "si-value" [ 5.41643e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0584288 5.39313 0 ] "si-unit" "m" "si-value" [ 5.84288e-12 5.39313e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0447548 0.203328 5.3475 ] "si-unit" "m" "si-value" [ -4.47548e-12 2.03328e-11 5.3475e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0133581 0.0277146 -0.124532 ] [ 1.5025 1.22494 1.34546 ] [ 0.0458685 2.70233 2.56072 ] [ 1.46199 4.10879 4.17844 ] [ 2.74075 -0.0340431 2.6907 ] [ 4.13695 1.41216 4.09761 ] [ 2.75898 2.67415 0.0540851 ] [ 4.02257 4.13506 1.27654 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.33581e-12 2.77146e-12 -1.24532e-11 ] [ 1.5025e-10 1.22494e-10 1.34546e-10 ] [ 4.58685e-12 2.70233e-10 2.56072e-10 ] [ 1.46199e-10 4.10879e-10 4.17844e-10 ] [ 2.74075e-10 -3.40431e-12 2.6907e-10 ] [ 4.13695e-10 1.41216e-10 4.09761e-10 ] [ 2.75898e-10 2.67415e-10 5.40851e-12 ] [ 4.02257e-10 4.13506e-10 1.27654e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.8647285 -3.0239601 4.3834547 ] [ -2.4098251 1.4651228 -0.9172586 ] [ 0.7645448 0.6195086 1.6557244 ] [ -2.7836792 0.589055 -4.152816 ] [ 0.6801305 0.5972671 2.470058 ] [ -3.3916434 3.0235497 -3.9831496 ] [ 2.0880936 -2.3445994 0.855094 ] [ 2.1876503 -0.9259437 -0.3111068 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.589801027639453e-09 -4.844918174452031e-09 7.023068638675878e-09 ] [ -3.860965435437022e-09 2.347385496761034e-09 -1.469610284147739e-09 ] [ 1.224935804114212e-09 9.925621953045388e-10 2.652762924168107e-09 ] [ -4.459945734047248e-09 9.43770149365344e-10 -6.653544705684173e-09 ] [ 1.089689186193014e-09 9.569273839930157e-10 3.957469179620006e-09 ] [ -5.434011761570623e-09 4.844260641166854e-09 -6.381709166268872e-09 ] [ 3.345494747962107e-09 -3.756462343821708e-09 1.370011615386355e-09 ] [ 3.505002165146106e-09 -1.483525348317049e-09 -4.984480415319015e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -35.134955 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.629240347386007e-18 } }