Table 1.
Lattice constants a and c (Å), volume V (Å3), buckling (Å), F-C-C bond-angle in CF and F-B-C bond-angle in B-alloying system (°), d1 (Å) and d2 (Å) in the Li(Na)BCF2/Li(Na)B2C2F2 cathodes. The data for CF are also given for comparison.
BCF2 | LiBCF2 | NaBCF2 | B2C2F2 | LiB2C2F2 | NaB2C2F2 | CF | |
---|---|---|---|---|---|---|---|
a = b | 2.713 | 2.802 | 2.856 | 2.696 | 2.720 | 2.752 | 2.599 |
c | 11.630 | 11.479 | 12.451 | 15.895 | 15.759 | 16.798 | 11.403 |
V | 74.113 | 78.072 | 87.935 | 100.042 | 100.944 | 110.188 | 66.701 |
Buckling | 0.665 | 0.338 | 0.338 | 0.728 | 0.532 | 0.528 | 0.488 |
Bond-angle | 113.01 | 101.81 | 101.58 | 115.07 | 108.72 | 108.37 | 108.03 |
d1 | 3.364 | 3.539 | 3.527 | 5.502 | 5.627 | 5.615 | 3.249 |
d2 | 2.451 | 2.201 | 2.699 | 2.445 | 2.252 | 2.784 | 2.452 |