Related references
Note: Only part of the references are listed.Accurate structures and energetics of neutral-framework zeotypes from dispersion-corrected DFT calculations
Michael Fischer et al.
JOURNAL OF CHEMICAL PHYSICS (2017)
Benchmarking DFT-GGA calculations for the structure optimisation of neutral-framework zeotypes
Michael Fischer et al.
THEORETICAL CHEMISTRY ACCOUNTS (2016)
The role of long-range van der Waals forces in the relative stability of SiO2-zeolites
Erick I. Roman-Roman et al.
CHEMICAL PHYSICS LETTERS (2015)
A database of new zeolite-like materials
Ramdas Pophale et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2011)
A reactive force field for aqueous-calcium carbonate systems
Julian D. Gale et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2011)
A consistent and accurate ab initio parametrization of density functional dispersion correction (DFT-D) for the 94 elements H-Pu
Stefan Grimme et al.
JOURNAL OF CHEMICAL PHYSICS (2010)
Thermochemistry of Microporous and Mesoporous Materials
Alexandra Navrotsky et al.
CHEMICAL REVIEWS (2009)
Pair distribution functions calculated from interatomic potential models using the General Utility Lattice Program
Elizabeth R. Cope et al.
JOURNAL OF APPLIED CRYSTALLOGRAPHY (2007)
A computational investigation on substitution of magnesium for aluminium in AlPO4-5 microporous material
Anais Dorta-Urra et al.
MICROPOROUS AND MESOPOROUS MATERIALS (2006)
The hydrothermal synthesis of zeolites: History and development from the earliest days to the present time
CS Cundy et al.
CHEMICAL REVIEWS (2003)
Computational studies in the AlPO4-34 system
D Stojakovic et al.
JOURNAL OF POROUS MATERIALS (2001)
Thermochemistry of pure-silica zeolites
PM Piccione et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2000)