{ "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" [ [ 0.8982620000000002 0.7878404000000002 -1.1968546000000002 ] [ -0.44977630000000013 1.3180815000000001 -2.1683822000000004 ] [ -0.5736718000000001 0.41625240000000013 -1.6585730000000005 ] [ -0.3253593000000001 3.5943517000000007 -1.4682281000000001 ] [ 0.3248692000000001 -4.140488200000001 -1.0304352000000003 ] [ 1.3683837000000003 0.4008406000000001 1.5171231000000005 ] [ -0.35665860000000005 -3.5539878000000007 1.8996655000000005 ] [ -0.8860489000000003 1.1771092000000003 4.105684700000001 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.43917437575305e-09 1.262259469801721e-09 -1.917572458616936e-09 ] [ -7.206210724499273e-10 2.111799363608996e-09 -3.47413126579887e-09 ] [ -9.191235459722536e-10 6.669098636318902e-10 -2.657326884490119e-09 ] [ -5.212830638198535e-10 5.758786260672737e-09 -2.352360735821605e-09 ] [ 5.204978370579995e-10 -6.633793392738276e-09 -1.650939186689373e-09 ] [ 2.192392372423801e-09 6.422174379874446e-10 2.430699161695622e-09 ] [ -5.714300705272589e-10 -5.694116163768427e-09 3.043599651440343e-09 ] [ -1.419606832465558e-09 1.885936840368592e-09 6.578032038716264e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.301272 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.655887268290166e-18 } }