{ "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" [ 5.45078 0 0 ] "si-unit" "m" "si-value" [ 5.45078e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.124172 5.56718 0 ] "si-unit" "m" "si-value" [ 1.24172e-11 5.56718e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0770044 0.0388551 5.42613 ] "si-unit" "m" "si-value" [ -7.70044e-12 3.88551e-12 5.42613e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.041219 -0.09108 -0.141264 ] [ 1.43794 1.32483 1.35293 ] [ -0.00716544 2.71531 2.76218 ] [ 1.33045 4.09617 4.06457 ] [ 2.76499 -0.0409375 2.74385 ] [ 3.91349 1.4388 4.06995 ] [ 2.74821 2.70058 0.127143 ] [ 4.06928 4.06454 1.39302 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.1219e-12 -9.108e-12 -1.41264e-11 ] [ 1.43794e-10 1.32483e-10 1.35293e-10 ] [ -7.165440000000001e-13 2.71531e-10 2.76218e-10 ] [ 1.33045e-10 4.09617e-10 4.06457e-10 ] [ 2.76499e-10 -4.09375e-12 2.74385e-10 ] [ 3.91349e-10 1.4388e-10 4.069950000000001e-10 ] [ 2.74821e-10 2.70058e-10 1.27143e-11 ] [ 4.06928e-10 4.06454e-10 1.39302e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.5818337000000001 0.5922774000000001 1.5716467000000005 ] [ -1.6987723000000003 -0.9375155000000002 0.4139232000000001 ] [ -0.04727160000000001 -0.6537608000000001 -0.6006997000000001 ] [ 1.3925573000000002 0.16080000000000003 -0.24229860000000006 ] [ -1.3975460000000002 -0.6622905000000001 0.21652290000000005 ] [ 1.1454278000000002 0.040983700000000005 0.27446770000000004 ] [ -0.4272651000000001 0.6149780000000001 -1.2319786000000001 ] [ 1.6147036000000003 0.8445278000000003 -0.4015836000000001 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.322003513335612e-10 9.4893300330821e-10 2.518055598897472e-09 ] [ -2.721733263122644e-09 -1.502065415737623e-09 6.631780738467226e-10 ] [ -7.573745234780929e-11 -1.047440269355505e-09 -9.624270154615738e-10 ] [ 2.231122749184372e-09 2.5763000062464e-10 -3.88205152172571e-10 ] [ -2.239115527692557e-09 -1.061106355277943e-09 3.469079282478164e-10 ] [ 1.835177641974378e-09 6.566312597388097e-11 4.397457321047482e-10 ] [ -6.845541541037743e-10 9.853033739063427e-10 -1.973847310245915e-09 ] [ 2.587040357441595e-09 1.353082696775659e-09 -6.43407855216699e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -36.432456 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.837122924152469e-18 } }