{ "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" [ [ 0.6597253 -2.8690821 -0.2600266 ] [ 0.4349421 1.221965 1.0107224 ] [ 1.4833947 -1.079453 1.8296647 ] [ -2.5809739 3.607151 -4.3836868 ] [ -0.9498642 -1.0130258 1.4737437 ] [ -0.9551978 2.8526448 -1.6975943 ] [ 5.6181718 -2.2941658 5.341663 ] [ -3.710198 -0.4260341 -3.314486 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.05699646051864e-09 -4.596776301647651e-09 -4.166085427384643e-10 ] [ 6.968540697628913e-10 1.95780377056581e-09 1.619355812740401e-09 ] [ 2.37666032733944e-09 -1.729474374101202e-09 2.931446030394619e-09 ] [ -4.135176075543852e-09 5.779293047509733e-09 -7.023440561734231e-09 ] [ -1.521850226713103e-09 -1.623046266399157e-09 2.361197720644705e-09 ] [ -1.530395596008205e-09 4.570440843661603e-09 -2.719845921471586e-09 ] [ 9.001303583757721e-09 -3.675658839281917e-09 8.55828764530234e-09 ] [ -5.944392543113532e-09 -6.825818803072195e-10 -5.310392022920124e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.22873 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.644264805149482e-18 } }