{ "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" [ 5.40884 0 0 ] "si-unit" "m" "si-value" [ 5.40884e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0760511 5.4684 0 ] "si-unit" "m" "si-value" [ 7.60511e-12 5.4684e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0640574 0.226818 5.41063 ] "si-unit" "m" "si-value" [ 6.40574e-12 2.26818e-11 5.41063e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00830896 0.0131794 0.144184 ] [ 1.38941 1.30499 1.31845 ] [ 0.000666759 2.66681 2.72971 ] [ 1.38566 4.09949 4.22322 ] [ 2.74889 -0.0321093 2.66684 ] [ 4.05308 1.21875 4.179 ] [ 2.6535 2.74282 -0.0977168 ] [ 4.21539 3.9917 1.44444 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -8.308960000000001e-13 1.31794e-12 1.44184e-11 ] [ 1.38941e-10 1.30499e-10 1.31845e-10 ] [ 6.667589999999999e-14 2.66681e-10 2.72971e-10 ] [ 1.38566e-10 4.099490000000001e-10 4.223220000000001e-10 ] [ 2.74889e-10 -3.21093e-12 2.66684e-10 ] [ 4.05308e-10 1.21875e-10 4.179e-10 ] [ 2.6535e-10 2.74282e-10 -9.771680000000001e-12 ] [ 4.21539e-10 3.9917e-10 1.44444e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.5320057 -2.0846917 0.0122206 ] [ 0.451368 1.3485887 0.6797546 ] [ 1.1155167 -1.2130783 1.7697598 ] [ -2.5983767 2.7355678 -3.2869322 ] [ -0.440362 -0.800823 1.0666007 ] [ -0.9307071 2.165555 -1.5169887 ] [ 3.457763 -2.9128231 2.6900336 ] [ -1.5872076 0.7617045 -1.4144483 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.523670946723386e-10 -3.340044303315807e-09 1.957955961214848e-11 ] [ 7.231712569772544e-10 2.160677286215065e-09 1.089086928001256e-09 ] [ 1.787254776851967e-09 -1.943565691459809e-09 2.835467775991684e-09 ] [ -4.163058400771456e-09 4.382862773773291e-09 -5.266245924994709e-09 ] [ -7.055377010887296e-10 -1.283059887998918e-09 1.708882705268915e-09 ] [ -1.491157156432568e-09 3.469601592056544e-09 -2.430483829157785e-09 ] [ 5.539947038867271e-09 -4.66685707134618e-09 4.309908943086458e-09 ] [ -2.542986909076078e-09 1.220385141858154e-09 -2.266195997590305e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -16.718289038775918 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.678565183770368e-18 } }