{ "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" [ 5.40534 0 0 ] "si-unit" "m" "si-value" [ 5.40534e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0241155 5.39517 0 ] "si-unit" "m" "si-value" [ 2.41155e-12 5.395170000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0520891 0.00914509 5.32386 ] "si-unit" "m" "si-value" [ -5.20891e-12 9.14509e-13 5.32386e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0541257 0.0304247 -0.104173 ] [ 1.34 1.36746 1.32858 ] [ -0.0983731 2.60813 2.63031 ] [ 1.3236 4.08084 4.09012 ] [ 2.69861 0.0115312 2.71277 ] [ 4.03614 1.39677 4.05029 ] [ 2.56533 2.8449 0.01686 ] [ 4.17154 4.11014 1.29552 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -5.41257e-12 3.04247e-12 -1.04173e-11 ] [ 1.34e-10 1.36746e-10 1.32858e-10 ] [ -9.837310000000001e-12 2.60813e-10 2.63031e-10 ] [ 1.3236e-10 4.08084e-10 4.09012e-10 ] [ 2.69861e-10 1.15312e-12 2.71277e-10 ] [ 4.03614e-10 1.39677e-10 4.05029e-10 ] [ 2.56533e-10 2.8449e-10 1.686e-12 ] [ 4.17154e-10 4.11014e-10 1.29552e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.9226135 0.0754193 2.5203081 ] [ -0.4796747 -0.6769888 -0.2442695 ] [ 1.9110587 1.7237022 0.5652527 ] [ -2.1886292 1.072862 -4.3337023 ] [ 0.127856 0.0188059 -0.4768154 ] [ -2.6497869 0.969546 -0.9134332 ] [ 3.7017833 -2.6298427 2.3387691 ] [ -2.3452205 -0.5535038 0.5438904 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.080366400534461e-09 1.208350392171014e-10 4.037978715032868e-09 ] [ -7.685235899292537e-10 -1.084655627903447e-09 -3.913628820745056e-10 ] [ 3.061853570116441e-09 2.761675366061526e-09 9.056346607840763e-10 ] [ -3.506570535840207e-09 1.71891441374473e-09 -6.943356506567188e-09 ] [ 2.048478940290048e-10 3.013037331310272e-11 -7.639424863174004e-10 ] [ -4.245426621282108e-09 1.553383933990157e-09 -1.463481317702531e-09 ] [ 5.930910658527874e-09 -4.213472490321549e-09 3.747121173469458e-09 ] [ -3.757457455720887e-09 -8.86810847883959e-10 8.714084831575603e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -35.76105 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.729551824525984e-18 } }