LiCrPO4 crystallizes in the orthorhombic Fdd2 space group. Li(1) is bonded in a 6-coordinate geometry to two equivalent O(1) and four equivalent O(2) atoms. Cr(1) is bonded in a distorted rectangular see-saw-like geometry to two equivalent O(1) and two equivalent O(2) atoms. P(1) is bonded in a tetrahedral geometry to two equivalent O(1) and two equivalent O(2) atoms. There are two inequivalent O sites. In the first O site, O(1) is bonded in a 3-coordinate geometry to one Li(1), one Cr(1), and one P(1) atom. In the second O site, O(2) is bonded to two equivalent Li(1), one Cr(1), and one P(1) atom to form a mixture of distorted corner and edge-sharing OLi2CrP trigonal pyramids.
LiCrPO4 crystallizes in the orthorhombic Fdd2 space group. Li(1) is bonded in a 6-coordinate geometry to two equivalent O(1) and four equivalent O(2) atoms. Both Li(1)-O(1) bond lengths are 2.38 Å. There are two shorter (2.10 Å) and two longer (2.33 Å) Li(1)-O(2) bond lengths. Cr(1) is bonded in a distorted rectangular see-saw-like geometry to two equivalent O(1) and two equivalent O(2) atoms. Both Cr(1)-O(1) bond lengths are 1.99 Å. Both Cr(1)-O(2) bond lengths are 2.09 Å. P(1) is bonded in a tetrahedral geometry to two equivalent O(1) and two equivalent O(2) atoms. Both P(1)-O(1) bond lengths are 1.55 Å. Both P(1)-O(2) bond lengths are 1.56 Å. There are two inequivalent O sites. In the first O site, O(1) is bonded in a 3-coordinate geometry to one Li(1), one Cr(1), and one P(1) atom. In the second O site, O(2) is bonded to two equivalent Li(1), one Cr(1), and one P(1) atom to form a mixture of distorted corner and edge-sharing OLi2CrP trigonal pyramids.