TY  - JOUR
AU  - Delgado, Alain
AU  - Casares, Pablo A. M.
AU  - dos Reis, Roberto
AU  - Zini, Modjtaba Shokrian
AU  - Campos, Roberto
AU  - Cruz Hernández, Norge
AU  - Voigt, Arne Christian
AU  - Lowe, Angus
AU  - Jahangiri, Soran
AU  - Martín-Delgado Alcántara, Miguel Ángel
AU  - Mueller, Jonathan
AU  - Arrazola, Juan Miguel
PY  - 2022
DO  - 10.1103/PhysRevA.106.032428
SN  - 2469-9926
UR  - https://hdl.handle.net/20.500.14352/72602
T2  - Physical review A
AB  - There is a pressing need to develop new rechargeable battery technologies that can offer higher energy storage, faster charging, and lower costs. Despite the success of existing methods for the simulation of battery materials, they can sometimes fall...
LA  - eng
PB  - Amer Physical Soc
KW  - Cathode materials
KW  - Energy-storage
KW  - Surface chemistry
KW  - Basis sets
KW  - Li
KW  - Challenges
KW  - Mechanisms
KW  - State
KW  - Stability
KW  - Diffusion.
TI  - Simulating key properties of lithium-ion batteries with a fault-tolerant quantum computer
TY  - journal article
VL  - 106
ER  -