TY  - JOUR 
AU  - Pimentel, Carlos
AU  - Pérez de la Luz, Alexander
AU  - Hernández Laguna, Alfonso
AU  - Sainz Díaz, Claro Ignacio
PY  - 2022
UR  - http://hdl.handle.net/10481/75416
AB  - Layered double hydroxides (LDH) are interesting materials due to their high absorption and catalytic properties.
Their applications in environment, agriculture and pharmaceutical fields are becoming widely important. The
interlayer and intralayer...
LA  - eng
PB  - Elsevier
KW  - DFT
KW  - Quantum Espresso
KW  - CASTEP
KW  - Cation ordering
KW  - LDH
KW  - Vibrational properties
TI  - Effects of the cation ordering in Mg:Al and Zn:Al layered double hydroxides on crystallographic and spectroscopical properties by means of first principles calculations
DO  - 10.1016/j.clay.2022.106496
ER  -