{ "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" [ 5.45078 0 0 ] "si-unit" "m" "si-value" [ 5.45078e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.124172 5.56718 0 ] "si-unit" "m" "si-value" [ 1.24172e-11 5.56718e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0770044 0.0388551 5.42613 ] "si-unit" "m" "si-value" [ -7.70044e-12 3.88551e-12 5.42613e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.041219 -0.09108 -0.141264 ] [ 1.43794 1.32483 1.35293 ] [ -0.00716544 2.71531 2.76218 ] [ 1.33045 4.09617 4.06457 ] [ 2.76499 -0.0409375 2.74385 ] [ 3.91349 1.4388 4.06995 ] [ 2.74821 2.70058 0.127143 ] [ 4.06928 4.06454 1.39302 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.1219e-12 -9.108e-12 -1.41264e-11 ] [ 1.43794e-10 1.32483e-10 1.35293e-10 ] [ -7.165440000000001e-13 2.71531e-10 2.76218e-10 ] [ 1.33045e-10 4.09617e-10 4.06457e-10 ] [ 2.76499e-10 -4.09375e-12 2.74385e-10 ] [ 3.91349e-10 1.4388e-10 4.069950000000001e-10 ] [ 2.74821e-10 2.70058e-10 1.27143e-11 ] [ 4.06928e-10 4.06454e-10 1.39302e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.33942500000000003 0.5720698000000001 2.1104901000000003 ] [ -2.9257058000000002 -1.7455154000000004 -0.19216510000000006 ] [ 0.7897976000000002 -1.3334163000000003 -0.6565077000000001 ] [ 1.4031021000000001 0.4304357000000001 -0.7812034000000002 ] [ -0.7838387000000002 -1.1925425000000003 0.8344452000000002 ] [ 0.25109650000000006 0.8314692000000002 0.32016530000000004 ] [ -0.39639990000000014 0.8464196000000003 -0.4390707000000001 ] [ 2.0013732000000006 1.5910798000000004 -1.1961537000000002 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.438187995150401e-10 9.16556859025732e-10 3.381377896649854e-09 ] [ -4.687497432098962e-09 -2.796623965126361e-09 -3.078824305536942e-10 ] [ 1.26539524988395e-09 -2.13636842165364e-09 -1.05184128831518e-09 ] [ 2.248017381215384e-09 6.896340152976828e-10 -1.251625823569471e-09 ] [ -1.255848039618265e-09 -1.910663712810384e-09 1.33692859077878e-09 ] [ 4.023009418647073e-10 1.33216051315528e-09 5.129613584514183e-10 ] [ -6.351026522674581e-10 1.356113694506888e-09 -7.034688104182907e-10 ] [ 3.206553350535684e-09 2.549190857387141e-09 -1.916449493023417e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -216.67009 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.471437526246319e-17 } }