{ "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" [ 5.5612 0 0 ] "si-unit" "m" "si-value" [ 5.5612e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0917257 5.43287 0 ] "si-unit" "m" "si-value" [ -9.17257e-12 5.432870000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0143429 0.0662566 5.45634 ] "si-unit" "m" "si-value" [ -1.43429e-12 6.62566e-12 5.45634e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00266051 0.00288647 -0.0538151 ] [ 1.22385 1.29926 1.47737 ] [ 0.0401458 2.69595 2.81688 ] [ 1.24418 4.12341 4.00905 ] [ 2.75119 0.03974 2.60779 ] [ 4.10264 1.45712 4.11323 ] [ 2.59294 2.8546 -0.123929 ] [ 4.00842 4.13916 1.33335 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -2.66051e-13 2.88647e-13 -5.38151e-12 ] [ 1.22385e-10 1.29926e-10 1.47737e-10 ] [ 4.01458e-12 2.69595e-10 2.81688e-10 ] [ 1.24418e-10 4.12341e-10 4.00905e-10 ] [ 2.75119e-10 3.974e-12 2.60779e-10 ] [ 4.10264e-10 1.45712e-10 4.11323e-10 ] [ 2.59294e-10 2.8546e-10 -1.23929e-11 ] [ 4.00842e-10 4.139160000000001e-10 1.33335e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.37401989999999996 -2.4107107999999995 -1.0593924999999997 ] [ 3.4210600999999996 2.5507838999999994 -11.129454499999998 ] [ -14.919050899999998 -0.9188283999999999 -6.568924699999999 ] [ 1.7565664999999997 20.098131399999996 -1.1849031999999997 ] [ -0.8829855999999999 0.40014169999999993 13.376039499999997 ] [ -3.7598019999999996 -1.6135857999999998 -0.7179340999999999 ] [ 7.428394299999999 -11.103343599999999 10.526269799999998 ] [ 7.329837499999999 -7.002588499999999 -3.2417001999999995 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.992459444310165e-10 -3.862384515091446e-09 -1.697333909734845e-09 ] [ 5.481142555729702e-09 4.086806362963392e-09 -1.783135194906615e-08 ] [ -2.390295475343666e-08 -1.472125393135605e-09 -1.052457766484546e-08 ] [ 2.814329802367161e-09 3.22007565161417e-08 -1.898424220591828e-09 ] [ -1.41469889647847e-09 6.410976820290376e-10 2.143077794236104e-08 ] [ -6.023866912866466e-09 -2.585249465714197e-09 -1.150257239771819e-09 ] [ 1.190159977559878e-08 -1.778951767519344e-08 1.686494351673985e-08 ] [ 1.174369437351697e-08 -1.121938367221711e-08 -5.193776314873126e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -31.996245 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.126363611473932e-18 } }