{ "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" [ 5.39143 0 0 ] "si-unit" "m" "si-value" [ 5.39143e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.144963 5.17841 0 ] "si-unit" "m" "si-value" [ 1.44963e-11 5.178410000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.144779 0.421312 5.38784 ] "si-unit" "m" "si-value" [ -1.44779e-11 4.21312e-11 5.38784e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.15223 0.0692904 -0.00428898 ] [ 1.42734 1.24068 1.17973 ] [ -0.332931 2.76994 2.80275 ] [ 1.2591 4.25807 3.96691 ] [ 2.6931 0.104845 2.7319 ] [ 4.09744 1.52781 4.38962 ] [ 2.50984 2.47613 -0.202936 ] [ 4.16866 4.11218 1.07304 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5223e-11 6.929040000000001e-12 -4.288980000000001e-13 ] [ 1.42734e-10 1.24068e-10 1.17973e-10 ] [ -3.32931e-11 2.76994e-10 2.80275e-10 ] [ 1.2591e-10 4.25807e-10 3.96691e-10 ] [ 2.6931e-10 1.04845e-11 2.7319e-10 ] [ 4.09744e-10 1.52781e-10 4.38962e-10 ] [ 2.50984e-10 2.47613e-10 -2.02936e-11 ] [ 4.16866e-10 4.11218e-10 1.07304e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.959985 -1.0494476 0.5604251 ] [ -0.0771977 1.0107898 1.9303517 ] [ 0.377512 -0.2285299 -0.9566078 ] [ -0.5181569 -0.0676623 -1.1896175 ] [ 0.7039032 0.2028365 0.1165366 ] [ -1.4271103 0.6543858 -1.0205724 ] [ 0.7739291 0.4036697 0.2967936 ] [ -0.7928644 -0.926042 0.2626907 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.538065523318688e-09 -1.68140040947467e-09 8.978999929295021e-10 ] [ -1.236843501195321e-10 1.619463786103108e-09 3.092764363661535e-09 ] [ 6.048409004714497e-10 -3.661452629337619e-10 -1.532654652434922e-09 ] [ -8.301788710862037e-10 -1.084069551695558e-10 -1.905977346194544e-09 ] [ 1.127777250346307e-09 3.249798981448992e-10 1.867122159875213e-10 ] [ -2.286482757962875e-09 1.048441629743505e-09 -1.635137239113746e-09 ] [ 1.239971110176785e-09 6.467501558653499e-10 4.755157671230669e-10 ] [ -1.27030880514462e-09 -1.483682842278874e-09 4.208768980415866e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 163.95259 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.626810066176079e-17 } }