{ "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" [ 5.44188 0 0 ] "si-unit" "m" "si-value" [ 5.44188e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0681259 5.43851 0 ] "si-unit" "m" "si-value" [ -6.812590000000001e-12 5.43851e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.00252152 -0.017859 5.5414 ] "si-unit" "m" "si-value" [ -2.52152e-13 -1.7859e-12 5.5414e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.00431502 -0.0137584 0.0307734 ] [ 1.33409 1.32426 1.37744 ] [ 0.0396224 2.60036 2.83022 ] [ 1.35045 4.04355 3.98016 ] [ 2.67673 0.013858 2.80413 ] [ 4.08887 1.41719 3.918 ] [ 2.72143 2.70354 0.017408 ] [ 3.9766 4.07774 1.36794 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.31502e-13 -1.37584e-12 3.07734e-12 ] [ 1.33409e-10 1.32426e-10 1.37744e-10 ] [ 3.962240000000001e-12 2.60036e-10 2.83022e-10 ] [ 1.35045e-10 4.04355e-10 3.98016e-10 ] [ 2.67673e-10 1.3858e-12 2.80413e-10 ] [ 4.08887e-10 1.41719e-10 3.918e-10 ] [ 2.72143e-10 2.70354e-10 1.7408e-12 ] [ 3.9766e-10 4.077740000000001e-10 1.36794e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.4337747 -0.3550865 -1.0484762 ] [ 0.166146 0.0998522 -1.2500449 ] [ 0.1372377 1.2918815 -1.1055306 ] [ -0.3413431 0.1079867 1.8581709 ] [ 0.464452 -0.1317178 -0.2280621 ] [ -0.5614767 -0.7388478 2.1734479 ] [ -0.0577466 -0.2614873 -0.5560617 ] [ 0.6265054 -0.0125809 0.1565566 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.949836830345338e-10 -5.689112886616993e-10 -1.679844055105225e-09 ] [ 2.661952368394368e-10 1.599808603754458e-10 -2.002792713730274e-09 ] [ 2.198790344323641e-10 2.069822336144035e-09 -1.771255280898996e-09 ] [ -5.468919344913965e-10 1.730137660973434e-10 2.977117973430895e-09 ] [ 7.441341358838017e-10 -2.110351797032102e-10 -3.653957647105517e-10 ] [ -8.995848418639355e-10 -1.183764671489514e-09 3.482247411906857e-09 ] [ -9.252025245068929e-11 -4.189488386961159e-10 -8.909090554623034e-10 ] [ 1.003772304684952e-09 -2.015682384862272e-11 2.508313243519373e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 148.21103 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.374602472106874e-17 } }