Structure

Parameters (Å)

Atom

x

y

z

NaBH₄

Pnma

(100 GPa)

a = 5.40200

b = 3.30400

c = 4.24700

Na

−0.16590

0.25000

0.29590

B

−0.08200

0.25000

−0.20000

H1

−0.41260

0.25000

−0.44860

H2

0.09210

0.49150

0.36400

H3

0.23620

0.25000

−0.42360

NaBH₆

R3m

(100 GPa)

a = 3.34773

b = 3.34773

c = 8.48000

Na

0.00000

0.00000

0.57737

B

0.00000

0.00000

0.08333

H1

0.18646

0.37293

0.03870

H2

0.00000

0.00000

0.21829

H3

0.00000

0.00000

0.80161

H4

0.00000

0.00000

0.88728