Abstract: A class of compositions in the Li—Mn—O—F chemical space for Li-ion cathode materials. The compositions are cobalt-free, high-capacity Li-ion battery cathode materials synthesized with cation-disordered rocksalt (DRX) oxide or oxyfluorides, with the general formula LixMn2-xO2-yFy (1.1?x?1.3333; 0?y?0.6667). The compositions are characterized by: (i) high capacities (e.g., >240 mAh/g); (ii) high energy densities (e.g., >750 Wh/kg between 1.5-4.8V); (iii) favorable cyclability; and (iv) low cost.

Abstract: A class of compositions that are inclusive of a lithium metal oxide or oxyfluoride compound having a general formula: LiTM[n]OF where TM[n] represents a number of transition metal species inclusive of transitional metal species differentiated by charge or d0 electron shell conformation, with [n] being at least 4 of said transitional metal species, and wherein said lithium metal oxide or oxyfluoride has a cation-disordered rocksalt (DRX) structure and a mitigated SRO via a high entropy DRX design strategy. Also featured is a method of synthesizing the high entropy DRX lithium metal oxide or oxyfluoride compounds, as well as usage of the same in Li-ion batteries, with particular utility in cathodes of such Li-ion batteries.

Abstract: A disordered rocksalt lithium metal oxide and oxyfluoride as in manganese-vanadium oxides and oxyfluorides well suited for use in high capacity lithium-ion battery electrodes such as those found in lithium-ion rechargeable batteries. A lithium metal oxide or oxyfluoride example is one having a general formula: LixM?aM?bO2-yFy, with the lithium metal oxide or oxyfluoride having a cation-disordered rocksalt structure of one of (a) or (b), with (a) 1.09?x?1.35, 0.1?a?0.7, 0.1?b?0.7, and 0?y?0.7; M? is a low valent transition metal and M? is a high-valent transition metal; and (b) 1.1?x?1.33, 0.1?a?0.41, 0.39?b?0.67, and 0?y?0.3; M? is Mn; and M? is V or Mo. The oxides or oxyfluorides balance accessible Li capacity and transition metal capacity. An immediate application example is for high energy density Li-cathode battery materials, where the cathode energy is a key limiting factor to overall performance. The second structure (b) is optimized for maximal accessible Li capacity.

Abstract: A class of compositions in the Li—Mn—O—F chemical space for Li-ion cathode materials. The compositions are cobalt-free, high-capacity Li-ion battery cathode materials synthesized with cation-disordered rocksalt (DRX) oxide or oxyfluorides, with the general formula LixMn2-xO2-yFy (1.1?x?1.3333; 0?y?0.6667). The compositions are characterized by: (i) high capacities (e.g., >240 mAh/g); (ii) high energy densities (e.g., >750 Wh/kg between 1.5-4.8V); (iii) favorable cyclability; and (iv) low cost.

Abstract: A disordered rocksalt lithium metal oxide and oxyfluoride as in manganese-vanadium oxides and oxyfluorides well suited for use in high capacity lithium-ion battery electrodes such as those found in lithium-ion rechargeable batteries. A lithium metal oxide or oxyfluoride example is one having a general formula: LixM?aM?bO2-yFy, with the lithium metal oxide or oxyfluoride having a cation-disordered rocksalt structure of one of (a) or (b), with (a) 1.09?x?1.35, 0.1?a?0.7, 0.1?b?0.7, and 0?y<0.7; M? is a low valent transition metal and M? is a high-valent transition metal; and (b) 1.1?x?1.33, 0.1?a?0.41, 0.39?b?0.67, and 0?y?0.3; M? is Mn; and M? is V or Mo. The oxides or oxyfluorides balance accessible Li capacity and transition metal capacity. An immediate application example is for high energy density Li-cathode battery materials, where the cathode energy is a key limiting factor to overall performance. The second structure (b) is optimized for maximal accessible Li capacity.