{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.474350000000001e-10 0.0 0.0 ] "source-value" [ 5.47435 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -7.16605e-11 5.34737e-10 0.0 ] "source-value" [ -0.716605 5.34737 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -2.76149e-11 -1.65536e-11 5.698150000000001e-10 ] "source-value" [ -0.276149 -0.165536 5.69815 ] } "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" [ [ -6.970635806583577e-09 -1.011429779669936e-08 -9.515954203078244e-09 ] [ -1.896771079113765e-09 -6.874843108384903e-09 2.626068530770674e-08 ] [ 3.584857051191709e-09 -1.244855986475942e-09 2.891835233429345e-09 ] [ -3.935298115345481e-08 -6.196494312507618e-08 4.163689161685298e-08 ] [ 3.382840988318203e-08 5.405128089951463e-08 -4.55486623933709e-08 ] [ 1.112932923736933e-09 5.443747227589251e-09 3.733105652826023e-09 ] [ 1.277772929455005e-08 1.946893828867132e-08 -1.769982720074394e-08 ] [ -3.083541273726238e-09 1.23497392129651e-09 -1.758073853404351e-09 ] ] "source-value" [ [ -4.3507287 -6.3128482 -5.9393915 ] [ -1.1838714 -4.2909396 16.3906307 ] [ 2.2374918 -0.776978 1.8049416 ] [ -24.5621991 -38.6754758 25.9877039 ] [ 21.1140329 33.7361563 -28.4292392 ] [ 0.6946381 3.3977198 2.3300213 ] [ 7.9752314 12.1515556 -11.0473633 ] [ -1.9245951 0.7708101 -1.0973034 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.69074e-11 4.07786e-12 -1.11283e-11 ] [ 1.40941e-10 1.27172e-10 1.01322e-10 ] [ -3.06599e-11 2.71071e-10 2.41068e-10 ] [ 1.07784e-10 4.29368e-10 3.98414e-10 ] [ 2.55814e-10 1.58673e-11 3.18004e-10 ] [ 3.994e-10 1.24784e-10 4.28471e-10 ] [ 2.16355e-10 2.62993e-10 -1.60126e-11 ] [ 3.70597e-10 4.39593e-10 1.80666e-10 ] ] "source-value" [ [ 0.269074 0.0407786 -0.111283 ] [ 1.40941 1.27172 1.01322 ] [ -0.306599 2.71071 2.41068 ] [ 1.07784 4.29368 3.98414 ] [ 2.55814 0.158673 3.18004 ] [ 3.994 1.24784 4.28471 ] [ 2.16355 2.62993 -0.160126 ] [ 3.70597 4.39593 1.80666 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -3.065408800037996e-18 "source-value" -19.132777 } }