{ "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" [ 5.3952 0 0 ] "si-unit" "m" "si-value" [ 5.3952e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00461172 5.6034 0 ] "si-unit" "m" "si-value" [ 4.61172e-13 5.6034e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.071329 0.0469434 5.27588 ] "si-unit" "m" "si-value" [ 7.132900000000001e-12 4.694340000000001e-12 5.27588e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0148313 -0.0405976 0.0741579 ] [ 1.40662 1.33729 1.44565 ] [ 0.021393 2.68696 2.73819 ] [ 1.3197 4.02815 4.06112 ] [ 2.69728 0.0386556 2.72588 ] [ 4.00631 1.34667 3.9586 ] [ 2.7243 2.85873 -0.0805011 ] [ 4.14392 4.06243 1.15826 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.48313e-12 -4.05976e-12 7.41579e-12 ] [ 1.40662e-10 1.33729e-10 1.44565e-10 ] [ 2.1393e-12 2.68696e-10 2.73819e-10 ] [ 1.3197e-10 4.02815e-10 4.06112e-10 ] [ 2.69728e-10 3.86556e-12 2.72588e-10 ] [ 4.00631e-10 1.34667e-10 3.9586e-10 ] [ 2.7243e-10 2.85873e-10 -8.050110000000001e-12 ] [ 4.14392e-10 4.06243e-10 1.15826e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.8156521000000002 0.8382507000000002 -1.0001311000000002 ] [ -0.6495922000000001 0.7470286000000002 -1.7449114000000003 ] [ -0.3967999000000001 0.5294471000000001 -1.2913132000000003 ] [ -0.35371810000000004 2.7542427000000003 -1.3710323000000002 ] [ 0.022302900000000004 -2.7615993000000003 -0.5285224000000001 ] [ 1.1798630000000003 0.22303840000000005 1.2809751000000003 ] [ 0.006516000000000002 -2.7499640000000003 1.5773537000000004 ] [ -0.6242239000000002 0.4195558000000001 3.077581500000001 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.306818725326424e-09 1.343025673909235e-09 -1.602386666154987e-09 ] [ -1.040761435894038e-09 1.196871757988955e-09 -2.795656250447398e-09 ] [ -6.35743522915778e-10 8.482677655703598e-10 -2.068911819170435e-09 ] [ -5.667188701737966e-10 4.412783261949069e-09 -2.196635897421652e-09 ] [ 3.573318495604033e-11 -4.424569834477646e-09 -8.46786232849106e-10 ] [ 1.890348914346951e-09 3.573469100206388e-10 2.052348357046942e-09 ] [ 1.04397828611328e-11 -4.405928028841651e-09 2.527199220872377e-09 ] [ -1.000116938724597e-09 6.722024938810408e-10 4.930829127906596e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.678889 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.716388181191829e-18 } }