{ "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" [ 5.33088 0 0 ] "si-unit" "m" "si-value" [ 5.33088e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0480326 5.46857 0 ] "si-unit" "m" "si-value" [ 4.80326e-12 5.46857e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.109209 0.182969 5.33745 ] "si-unit" "m" "si-value" [ -1.09209e-11 1.82969e-11 5.33745e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0970486 -0.0788825 -0.10937 ] [ 1.39157 1.38931 1.26283 ] [ -0.0444574 2.82173 2.6602 ] [ 1.24826 4.17435 3.90061 ] [ 2.67605 0.0682538 2.80056 ] [ 3.9766 1.50429 4.31462 ] [ 2.81042 2.80539 0.0255717 ] [ 4.1826 4.03217 1.44291 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -9.70486e-12 -7.88825e-12 -1.0937e-11 ] [ 1.39157e-10 1.38931e-10 1.26283e-10 ] [ -4.44574e-12 2.82173e-10 2.6602e-10 ] [ 1.24826e-10 4.17435e-10 3.90061e-10 ] [ 2.67605e-10 6.825380000000001e-12 2.80056e-10 ] [ 3.9766e-10 1.50429e-10 4.31462e-10 ] [ 2.81042e-10 2.80539e-10 2.55717e-12 ] [ 4.1826e-10 4.03217e-10 1.44291e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 5.858904 -5.9067887 4.851746 ] [ -0.5553809 0.8687391 0.7829389 ] [ 3.5621746 -9.2408807 2.9966724 ] [ 1.1805322 3.5666849 1.8655587 ] [ 0.1551822 -1.9853868 -1.7917888 ] [ -3.1995178 6.6986986 -6.2204774 ] [ -1.669431 -1.7325815 1.3065922 ] [ -5.3324634 7.7315152 -3.7912421 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.386999012311604e-09 -9.463718759145625e-09 7.773354011259917e-09 ] [ -8.898182936188627e-10 1.391873475594833e-09 1.254406401094869e-09 ] [ 5.707232863327592e-09 -1.480552301314194e-08 4.801198459476626e-09 ] [ 1.89142109094159e-09 5.714459160540386e-09 2.988954533870041e-09 ] [ 2.486292928043098e-10 -3.180940314204925e-09 -2.870762124771287e-09 ] [ -5.12619261699345e-09 1.073249828670569e-08 -9.966303460494771e-09 ] [ -2.674723318238765e-09 -2.775901572930596e-09 2.093391475759638e-09 ] [ -8.54354819075168e-09 1.238725289679983e-08 -6.074239456412696e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -27.310881 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.375685503165092e-18 } }