{ "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" [ 5.45189 0 0 ] "si-unit" "m" "si-value" [ 5.451889999999999e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.103872 5.48254 0 ] "si-unit" "m" "si-value" [ 1.03872e-11 5.482540000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0133572 0.0848103 5.46172 ] "si-unit" "m" "si-value" [ -1.33572e-12 8.481030000000001e-12 5.46172e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0515087 0.139447 0.129479 ] [ 1.28089 1.29793 1.3896 ] [ -0.0267641 2.78569 2.67144 ] [ 1.28772 4.21003 3.97686 ] [ 2.71226 0.0930415 2.84614 ] [ 4.11731 1.46571 4.11351 ] [ 2.72029 2.73709 -0.0733662 ] [ 4.08924 4.18171 1.22387 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.15087e-12 1.39447e-11 1.29479e-11 ] [ 1.28089e-10 1.29793e-10 1.3896e-10 ] [ -2.67641e-12 2.78569e-10 2.67144e-10 ] [ 1.28772e-10 4.21003e-10 3.97686e-10 ] [ 2.71226e-10 9.304150000000001e-12 2.84614e-10 ] [ 4.11731e-10 1.46571e-10 4.11351e-10 ] [ 2.72029e-10 2.73709e-10 -7.336620000000001e-12 ] [ 4.089240000000001e-10 4.18171e-10 1.22387e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.2335116 -5.7428717 -6.3854832 ] [ 5.7015533 5.6560846 4.4240717 ] [ -0.1315639 0.1025598 -0.4427507 ] [ 0.5850635 0.2916548 1.9939891 ] [ -0.0461558 -0.5103586 -1.9123123 ] [ 0.1598686 -0.2280542 0.0955919 ] [ -1.0737619 0.20185 0.7623464 ] [ 0.0385078 0.2291355 1.4645471 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.385009930205602e-09 -9.201094773993952e-09 -1.023067189555117e-08 ] [ 9.134895399505088e-09 9.06204651138692e-09 7.088144246482912e-09 ] [ -2.107886047212691e-10 1.643189137939238e-10 -7.093648203828346e-10 ] [ 9.373750613834207e-10 4.672825019040998e-10 3.194722718150033e-09 ] [ -7.394974367432063e-11 -8.176846171442189e-10 -3.063862058728276e-09 ] [ 2.561377333200269e-10 -3.653831075152474e-10 1.531551073178515e-10 ] [ -1.720356212485788e-09 3.2339935090848e-10 1.221413579031045e-09 ] [ 6.169629687844225e-11 3.671155410953184e-10 2.34646312368044e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.60296 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.704223014327757e-18 } }