High-pressure phase transitions and equations of state in NiSi. III. A new high-pressure phase of NiSi

Wood, I.G.; Ahmed, J.; Dobson, D.P.; Vočadlo, L.

doi:10.1107/S0021889812047085

Figure 4
(a) Unit-cell parameters and (b), (c) atomic fractional z coordinates of the Pmmn phase of NiSi, as determined from the VASP simulations.