Accurately computed dimerization fraction of ALD precursors and their impact on surface reactivity in area-selective atomic layer deposition
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- Type
- preprint
- Published
- 2024-08-22
- Cited by
- 2
- References
- 78
- Access
- Open access
- OpenAlex
- https://openalex.org/W4401730275
Keywords
Atomic layer deposition, Reactivity (psychology), Deposition (geology), Layer (electronics), Fraction (chemistry)
References
- Thermodynamics and Thermochemistry of Organoaluminum Compounds
- Introduction to Computational Chemistry
- The monomer−dimer equilibria of liquid aliminum alkyls: III. Trimethylaluminum: the monomer−dimer equilibria of liquid and gaseous trimethylaluminum and triethylaluminum
- Improved initial guess for minimum energy path calculations.
- From ultrasoft pseudopotentials to the projector augmented-wave method
- Balanced basis sets of split valence, triple zeta valence and quadruple zeta valence quality for H to Rn: Design and assessment of accuracy.
- Carbon monoxide, carbon monosulfide, molecular nitrogen, phosphorus trifluoride, and methyl isocyanide as .sigma. donors and .pi. acceptors. A theoretical study by the Hartree-Fock-Slater transition-state method
- Atomic layer deposition (ALD): from precursors to thin film structures
- Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set
- Selective metalization by chemical vapor deposition
- A Gas Phase Electron Diffraction Investigation of the Molecular Structures of Trimethylaluminium Monomer and Dimer.
- Basis-set extrapolation
- Behavior of density functionals with respect to basis set. 3. Basis set superposition error.
- Development of the Colle-Salvetti correlation-energy formula into a functional of the electron density.
- Thermal decomposition of dimethylaluminum isopropoxide on Si(1 0 0)
- VESTA 3 for three-dimensional visualization of crystal, volumetric and morphology data
- Improved tangent estimate in the nudged elastic band method for finding minimum energy paths and saddle points
- First-Principles Investigation of C-H Bond Scission and Formation Reactions in Ethane, Ethene, and Ethyne Adsorbed on Ru(0001).
- SPECIAL POINTS FOR BRILLOUIN-ZONE INTEGRATIONS
- Monomer-dimer equilibria of triethylaluminium
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