{ "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" [ 5.49393 0 0 ] "si-unit" "m" "si-value" [ 5.49393e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.002595 5.45604 0 ] "si-unit" "m" "si-value" [ 2.595e-13 5.45604e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0698117 0.0748179 5.57684 ] "si-unit" "m" "si-value" [ -6.981170000000001e-12 7.48179e-12 5.57684e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0568347 0.000259582 0.0366732 ] [ 1.4042 1.34788 1.25876 ] [ -0.0116956 2.70772 2.89683 ] [ 1.4664 4.01047 4.21293 ] [ 2.72042 0.0465962 2.58375 ] [ 4.04434 1.40284 4.02526 ] [ 2.59741 2.72967 0.138309 ] [ 4.11134 4.10597 1.37335 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -5.683470000000001e-12 2.59582e-14 3.66732e-12 ] [ 1.4042e-10 1.34788e-10 1.25876e-10 ] [ -1.16956e-12 2.70772e-10 2.89683e-10 ] [ 1.4664e-10 4.01047e-10 4.21293e-10 ] [ 2.72042e-10 4.65962e-12 2.583750000000001e-10 ] [ 4.04434e-10 1.40284e-10 4.02526e-10 ] [ 2.59741e-10 2.72967e-10 1.38309e-11 ] [ 4.11134e-10 4.10597e-10 1.37335e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.0663318 -0.3331441 -1.31079 ] [ -1.701885 -0.2771651 0.6695732 ] [ 0.5250209 0.4318414 -0.3876726 ] [ -0.3039637 1.7781273 -0.9638636 ] [ -0.4656733 -0.552361 1.2892512 ] [ -0.8603651 -0.188826 1.0106007 ] [ 1.9004854 -0.0202099 -0.4448383 ] [ 0.9727125 -0.8382626 0.1377395 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.062752591755814e-10 -5.337556883774573e-10 -2.100117092778432e-09 ] [ -2.726720358290208e-09 -4.440674433216941e-10 1.072774526954243e-09 ] [ 8.411762114113748e-10 6.918861949735412e-10 -6.211199762447501e-10 ] [ -4.870035337118649e-10 2.848873988866228e-09 -1.544279725560123e-09 ] [ -7.460908741907847e-10 -8.849798804417087e-10 2.065608130978345e-09 ] [ -1.378456848572254e-09 -3.025326025991808e-10 1.619160814504114e-09 ] [ 3.044913276051736e-09 -3.237982928870592e-11 -7.127095242964167e-10 ] [ 1.55845722625992e-09 -1.343044739811022e-09 2.206830066606816e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 624.3312 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.000288852276009e-16 } }