{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.44714e-10 0.0 0.0 ] "source-value" [ 5.44714 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.03058e-11 5.37075e-10 0.0 ] "source-value" [ 0.103058 5.37075 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 4.54409e-12 8.808560000000001e-13 5.432070000000001e-10 ] "source-value" [ 0.0454409 0.00880856 5.43207 ] } "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" [ [ -1.683442223360218e-10 6.675747028424571e-09 1.202434835651697e-09 ] [ 9.521266059446845e-09 -1.15509865556429e-08 -1.286806770287854e-08 ] [ -9.18801684710901e-09 1.050709767098506e-08 1.408355563167755e-08 ] [ 9.160491292546003e-10 -7.531944446744256e-09 -6.211222192920192e-11 ] [ -1.815929092052087e-09 3.073308171649189e-09 6.149692041757327e-09 ] [ -4.635282816462413e-10 -2.173035835797268e-09 3.204772531221663e-09 ] [ 8.022396345197069e-10 3.634558652798532e-09 -4.486336947562727e-09 ] [ 3.962634597045465e-10 -2.634744685672929e-09 -7.223938167937775e-09 ] ] "source-value" [ [ -0.10507220000000003 4.166673600000001 0.7505008000000002 ] [ 5.942706900000001 -7.209558800000002 -8.031616200000002 ] [ -5.734709100000001 6.558014600000002 8.790264100000002 ] [ 0.5717529000000001 -4.7010700000000005 -0.03876740000000001 ] [ -1.1334138000000002 1.9182081000000004 3.838335900000001 ] [ -0.28931160000000006 -1.3563023000000003 2.0002617000000003 ] [ 0.5007186000000001 2.2685131000000003 -2.8001513000000005 ] [ 0.24732820000000005 -1.6444783000000005 -4.508827600000001 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -9.227900000000001e-12 -1.565e-11 1.40236e-11 ] [ 1.30169e-10 1.48453e-10 1.67094e-10 ] [ -6.4284e-12 2.41697e-10 2.49469e-10 ] [ 1.35107e-10 4.20911e-10 4.05148e-10 ] [ 2.6753e-10 4.24873e-12 2.71018e-10 ] [ 4.05146e-10 1.3988e-10 4.09778e-10 ] [ 2.74223e-10 2.69898e-10 4.20733e-11 ] [ 4.21922e-10 4.15138e-10 1.78205e-10 ] ] "source-value" [ [ -0.092279 -0.1565 0.140236 ] [ 1.30169 1.48453 1.67094 ] [ -0.064284 2.41697 2.49469 ] [ 1.35107 4.20911 4.05148 ] [ 2.6753 0.0424873 2.71018 ] [ 4.05146 1.3988 4.09778 ] [ 2.74223 2.69898 0.420733 ] [ 4.21922 4.15138 1.78205 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -4.537368676200138e-18 "source-value" -28.320028 } }