{ "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" [ 5.59774 0 0 ] "si-unit" "m" "si-value" [ 5.597740000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.20689 5.51351 0 ] "si-unit" "m" "si-value" [ -2.0689e-11 5.513510000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.513105 0.215809 5.94806 ] "si-unit" "m" "si-value" [ 5.131050000000001e-11 2.15809e-11 5.94806e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00246673 -0.00144352 -0.0330248 ] [ 1.48237 1.24989 1.2555 ] [ 0.11896 2.3805 2.33914 ] [ 1.62926 4.22989 4.16904 ] [ 2.92639 0.137476 2.28463 ] [ 4.54625 1.57381 3.68026 ] [ 3.00188 2.71108 0.0736878 ] [ 4.22934 4.27512 1.23802 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -2.46673e-13 -1.44352e-13 -3.30248e-12 ] [ 1.48237e-10 1.24989e-10 1.2555e-10 ] [ 1.1896e-11 2.3805e-10 2.33914e-10 ] [ 1.62926e-10 4.22989e-10 4.16904e-10 ] [ 2.92639e-10 1.37476e-11 2.28463e-10 ] [ 4.54625e-10 1.57381e-10 3.68026e-10 ] [ 3.00188e-10 2.71108e-10 7.36878e-12 ] [ 4.22934e-10 4.27512e-10 1.23802e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 4.3710408 4.0151057 -8.0770823 ] [ 0.1830291 -1.6885362 -11.8243554 ] [ 7.4040175 23.0535924 -7.9253669 ] [ -0.0720914 0.1122221 -0.3935755 ] [ 6.084361 -4.4169634 11.5240118 ] [ -14.4142932 -13.8434186 15.6645629 ] [ -2.2675118 -0.9610658 -4.1197142 ] [ -1.288552 -6.2709362 5.1515196 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.003179436020667e-09 6.432908535580214e-09 -1.294091253195498e-08 ] [ 2.932449473620494e-10 -2.70533324530315e-09 -1.894470593399172e-08 ] [ 1.186254383622709e-08 3.693592707303998e-08 -1.269783766305701e-08 ] [ -1.155031565923476e-10 1.797996264384114e-10 -6.30577469814867e-10 ] [ 9.748221027020872e-09 -7.076755552713196e-09 1.846350243590028e-08 ] [ -2.309424376066509e-08 -2.217960181560099e-08 2.509739666020327e-08 ] [ -3.63295442327928e-09 -1.539797168496517e-09 -6.600509829998002e-09 ] [ -2.064487906093968e-09 -1.004714745294475e-08 8.253644332713026e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -23.637281 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.787109930949216e-18 } }