LiMnVO4 is Spinel-derived structured and crystallizes in the tetragonal P4_322 space group. Li(1) is bonded to two equivalent O(2) and four equivalent O(1) atoms to form LiO6 octahedra that share corners with six equivalent Mn(1)O4 tetrahedra, edges with two equivalent Li(1)O6 octahedra, and edges with four equivalent V(1)O6 octahedra. V(1) is bonded to two equivalent O(1) and four equivalent O(2) atoms to form distorted VO6 octahedra that share corners with six equivalent Mn(1)O4 tetrahedra, edges with two equivalent V(1)O6 octahedra, and edges with four equivalent Li(1)O6 octahedra. Mn(1) is bonded to two equivalent O(1) and two equivalent O(2) atoms to form MnO4 tetrahedra that share corners with six equivalent Li(1)O6 octahedra and corners with six equivalent V(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 52-68°. There are two inequivalent O sites. In the first O site, O(1) is bonded to two equivalent Li(1), one V(1), and one Mn(1) atom to form distorted OLi2MnV trigonal pyramids that share corners with six equivalent O(1)Li2MnV trigonal pyramids, corners with six equivalent O(2)LiMnV2 trigonal pyramids,  an edgeedge with one O(1)Li2MnV trigonal pyramid, and edges with two equivalent O(2)LiMnV2 trigonal pyramids. In the second O site, O(2) is bonded to one Li(1), two equivalent V(1), and one Mn(1) atom to form distorted OLiMnV2 trigonal pyramids that share corners with six equivalent O(1)Li2MnV trigonal pyramids, corners with six equivalent O(2)LiMnV2 trigonal pyramids,  an edgeedge with one O(2)LiMnV2 trigonal pyramid, and edges with two equivalent O(1)Li2MnV trigonal pyramids.
LiMnVO4 is Spinel-derived structured and crystallizes in the tetragonal P4_322 space group. Li(1) is bonded to two equivalent O(2) and four equivalent O(1) atoms to form LiO6 octahedra that share corners with six equivalent Mn(1)O4 tetrahedra, edges with two equivalent Li(1)O6 octahedra, and edges with four equivalent V(1)O6 octahedra. Both Li(1)-O(2) bond lengths are 2.19 Å. There are two shorter (2.09 Å) and two longer (2.18 Å) Li(1)-O(1) bond lengths. V(1) is bonded to two equivalent O(1) and four equivalent O(2) atoms to form distorted VO6 octahedra that share corners with six equivalent Mn(1)O4 tetrahedra, edges with two equivalent V(1)O6 octahedra, and edges with four equivalent Li(1)O6 octahedra. Both V(1)-O(1) bond lengths are 1.78 Å. There are two shorter (1.90 Å) and two longer (2.11 Å) V(1)-O(2) bond lengths. Mn(1) is bonded to two equivalent O(1) and two equivalent O(2) atoms to form MnO4 tetrahedra that share corners with six equivalent Li(1)O6 octahedra and corners with six equivalent V(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 52-68°. Both Mn(1)-O(1) bond lengths are 2.05 Å. Both Mn(1)-O(2) bond lengths are 2.03 Å. There are two inequivalent O sites. In the first O site, O(1) is bonded to two equivalent Li(1), one V(1), and one Mn(1) atom to form distorted OLi2MnV trigonal pyramids that share corners with six equivalent O(1)Li2MnV trigonal pyramids, corners with six equivalent O(2)LiMnV2 trigonal pyramids,  an edgeedge with one O(1)Li2MnV trigonal pyramid, and edges with two equivalent O(2)LiMnV2 trigonal pyramids. In the second O site, O(2) is bonded to one Li(1), two equivalent V(1), and one Mn(1) atom to form distorted OLiMnV2 trigonal pyramids that share corners with six equivalent O(1)Li2MnV trigonal pyramids, corners with six equivalent O(2)LiMnV2 trigonal pyramids,  an edgeedge with one O(2)LiMnV2 trigonal pyramid, and edges with two equivalent O(1)Li2MnV trigonal pyramids.