A DFT-based simulated annealing method for the optimization of global energy in zeolite framework systems: Application to natrolite, chabazite and clinoptilolite
- Abatal, M.
- Ruiz-Salvador, A.R.
- Hernández, N.C.
Zeitschrift:
Microporous and Mesoporous Materials
ISSN: 1387-1811
Datum der Publikation: 2020
Ausgabe: 294
Art: Artikel