{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.41643e-10 0.0 0.0 ] "source-value" [ 5.41643 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.84288e-12 5.39313e-10 0.0 ] "source-value" [ 0.0584288 5.39313 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -4.47548e-12 2.03328e-11 5.3475e-10 ] "source-value" [ -0.0447548 0.203328 5.3475 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 2.190066492623386e-09 -1.506848393603697e-09 1.57960211243059e-09 ] [ -1.749825207289824e-09 3.720888575439437e-10 6.478335476963347e-10 ] [ 6.52919016508416e-10 1.010409962207265e-09 -8.999361991968768e-11 ] [ -2.934890846195428e-09 -6.492449050815974e-10 -2.47051164854588e-09 ] [ 4.119949115088577e-10 5.309036537747712e-11 2.444084386056432e-09 ] [ -2.261354380059909e-09 3.125743086571096e-09 -2.877705798028172e-09 ] [ 1.459739113769328e-09 -2.026028440391088e-09 2.418839690130797e-10 ] [ 2.231350738917511e-09 -3.792103724057376e-10 5.248072115149651e-10 ] ] "source-value" [ [ 1.366932 -0.9405008 0.9859101 ] [ -1.092155 0.2322396 0.4043459 ] [ 0.40752 0.6306483 -0.0561696 ] [ -1.8318148 -0.4052268 -1.5419721 ] [ 0.257147 0.0331364 1.5254775 ] [ -1.4114264 1.9509354 -1.7961227 ] [ 0.9110975 -1.2645475 0.1509721 ] [ 1.3926996 -0.2366845 0.3275589 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "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 ] ] "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 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 2.542667595275553e-17 "source-value" 158.70083 } }