{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.41643e-10 0.0 0.0 ] "source-value" [ 5.41643 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.84288e-12 5.39313e-10 0.0 ] "source-value" [ 0.0584288 5.39313 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -4.47548e-12 2.03328e-11 5.3475e-10 ] "source-value" [ -0.0447548 0.203328 5.3475 ] } "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" [ [ 5.828292367489267e-09 -6.286117861671434e-09 8.121452677172312e-09 ] [ -3.840865488858438e-09 2.525152119803981e-09 -1.815382269171408e-09 ] [ 7.427546618132928e-10 5.332700686436928e-10 2.054344188463473e-09 ] [ -4.469749773225247e-09 2.143318503617007e-09 -6.452448788865758e-09 ] [ 8.209668361695897e-10 8.061704146411775e-10 3.923593878673445e-09 ] [ -6.511853492523469e-09 6.156328737973666e-09 -7.402142024980537e-09 ] [ 3.723081634797988e-09 -4.120559223945777e-09 2.057876026606364e-09 ] [ 3.707373254337017e-09 -1.757562759062315e-09 -4.872936878978919e-10 ] ] "source-value" [ [ 3.637734 -3.9234862 5.0690121 ] [ -2.3972797 1.576076 -1.1330725 ] [ 0.463591 0.332841 1.2822208 ] [ -2.7897984 1.3377542 -4.0273018 ] [ 0.5124072 0.503172 2.4489147 ] [ -4.0643793 3.8424782 -4.6200537 ] [ 2.3237648 -2.5718508 1.2844252 ] [ 2.3139604 -1.0969844 -0.3041448 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.33581e-12 2.77146e-12 -1.24532e-11 ] [ 1.5025e-10 1.22494e-10 1.34546e-10 ] [ 4.58685e-12 2.70233e-10 2.56072e-10 ] [ 1.46199e-10 4.10879e-10 4.17844e-10 ] [ 2.74075e-10 -3.40431e-12 2.6907e-10 ] [ 4.13695e-10 1.41216e-10 4.09761e-10 ] [ 2.75898e-10 2.67415e-10 5.40851e-12 ] [ 4.02257e-10 4.13506e-10 1.27654e-10 ] ] "source-value" [ [ 0.0133581 0.0277146 -0.124532 ] [ 1.5025 1.22494 1.34546 ] [ 0.0458685 2.70233 2.56072 ] [ 1.46199 4.10879 4.17844 ] [ 2.74075 -0.0340431 2.6907 ] [ 4.13695 1.41216 4.09761 ] [ 2.75898 2.67415 0.0540851 ] [ 4.02257 4.13506 1.27654 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.609334424396201e-18 "source-value" -35.010712 } }