{ "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" [ [ 2.6220968 -3.1614791 4.9756072 ] [ -2.856982 2.2006829 -0.8898265 ] [ 0.7472563 0.5026099 2.2034389 ] [ -2.8157633 0.4696775 -4.9912562 ] [ 0.6542745 0.7568164 2.1868673 ] [ -2.9039404 2.9240739 -4.4859717 ] [ 2.0020933 -2.1202014 0.9496414 ] [ 2.5509648 -1.57218 0.0514997 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.201062190434493e-09 -5.065247901167826e-09 7.971801530124149e-09 ] [ -4.577389766446426e-09 3.525882692174344e-09 -1.425659214868291e-09 ] [ 1.197236573605511e-09 8.05269831162626e-10 3.53029829094127e-09 ] [ -4.511350128966656e-09 7.525063098157921e-10 -7.996873992063048e-09 ] [ 1.048263307485609e-09 1.212553542318021e-09 3.50374766085202e-09 ] [ -4.6526254170766e-09 4.684882840071477e-09 -7.187318979310432e-09 ] [ 3.20770707792032e-09 -3.396937114467429e-09 1.521493249223781e-09 ] [ 4.087096163043748e-09 -2.518910039689344e-09 8.251161531821377e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -32.54657 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.214535354123066e-18 } }