Melilite-type Ba2MnSi2O7 was synthesized
by a standard powder solid-state reaction route, and its magnetic
properties were studied at low temperature. The magnetic structure
was found to be C-type pointing along the c axis
from neutron powder diffraction, which is different from the G-type
ordering previously reported in all other 2-2-4-2 melilites with manganese
as the B′-site transition metal. Ab initio (density functional
theory) and magnetic dipole–dipole calculations were used to
understand the magnetic structure by determining the spin supersuperexchange
parameters as well as the relative influence of spin–orbit
coupling and the magnetic dipole–dipole interactions.