{ "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" [ [ 2.2664725 0.1973822 2.9150153 ] [ -0.7965761 -0.5751476 -0.2877814 ] [ 2.4445354 2.1328891 0.9350459 ] [ -2.0057606 0.462573 -4.2885441 ] [ 0.3012666 0.1784002 -0.3950274 ] [ -2.9027735 0.6167 -1.2507413 ] [ 3.9812552 -2.5060421 1.805075 ] [ -3.2884193 -0.5067548 0.5669581 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.631289251186128e-09 3.162411462020697e-10 4.670369362934298e-09 ] [ -1.276255604108043e-09 -9.2148803822923e-10 -4.610766309810932e-10 ] [ 3.916577466597977e-09 3.417265050779153e-09 1.498108680354895e-09 ] [ -3.213582740241781e-09 7.411236460133185e-10 -6.871005094289778e-09 ] [ 4.826823031479052e-10 2.858286295860442e-10 -6.329036648554099e-10 ] [ -4.650755837177789e-09 9.880623220473601e-10 -2.003908469528999e-09 ] [ 6.378674002878429e-09 -4.015122063360536e-09 2.89204896379056e-09 ] [ -5.268628521847502e-09 -8.119106930381797e-10 9.083670127931886e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -33.255816 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.328169090082658e-18 } }