Phase Diagram of Adsorbate-Induced Row-Type-Alignments
M. Kang, K. Yasutani, M. Kaburagi
Abstract
The phase diagram of adsorbate-induced row-type-alignments, such as missing-row reconstructions induced by adsorbate-atoms on the FCC(110) surface, is calculated by the Blume-Emmery-Griffiths (BEG) model. In the model, we introduce adatom-adatom and dipole-dipole interactions between nearest-neighbor (NN) and next-nearest-neighbor (NNN) rows. The calculation of the temperature versus adatom chemical potential phase diagram is performed using mean-field approximation. It is indicated that when NN and NNN interactions are competitive, there appear either dipole or coverage modulated (incommensurate) phases at high temperatures for wide regime of the interactions.
Create a lesson
Related papers
Temperature dependence of the charge density from first principles: application to the (222) forbidden reflection in silicon
Jean Paul Nery, Raveena Gupta, Olle Hellman et al.
Coupled anisotropic weak topological states and Floquet mixed-parity altermagnetism in two-dimensional Su-Schrieffer-Heeger models
Kunyuan Feng, Xibin Liu, Chenchen Liu et al.
Grain Boundary Phase Transitions Enable Diffusionless Climb of Disconnections
Md Sharier Nazim, Giacomo Po, Nikhil Chandra Admal
3D Cloud Component Analysis of Atomic Structures
Pai Li
Benchmarking of Fast and Interpretable UF Machine Learning Potentials
Pawan Prakash, Sam Dong, Richard G. Hennig
Grain-Boundary Premelting in High-Entropy Transition Metal Carbides
Marium M. Mou, Caleb Schenck, Samuel E. Daigle et al.