82 citations · 131 across the 7 of their papers we have counts for
7 papers
Construction of - hetero-layer intermetallic crystals: case studies of the 1144-phase TM-phosphides \textit{AB}(TM)P (TM=Fe, Ru, Co, Ni
B. Q. Song, Mingyu Xu, Vladislav Borisov +5
The discovery of the 1144-phase, e.g. CaKFeAs, creates opportunities to build novel intermetallics with alternative stacking of two parent compounds. Here we formalize the…
Observation of Al41Sm5: new evidence for structural hierarchy in Al-Sm alloys
Z. Ye, F. Meng, F. Zhang +9
Using an effective genetic algorithm, we uncover the structure of a metastable Al41Sm5 phase that supplements its family sharing similar short-range orders. The phase evolves upon…
Ab initio study on the electronic and magnetic properties of CaFe2As2 within a GGA + negative U approach
S. Wu, G. Wang, F. Pei +4
This paper has been withdrawn by the author due to the error in figure 2, we did not optimized c-value of the supercell, so the results can not give the true physics of this materi…
Gutzwiller density functional theory for correlated electron systems
K. M. Ho, J. Schmalian, C. Z. Wang
We develop a new density functional theory (DFT) and formalism for correlated electron systems by taking as reference an interacting electron system that has a ground state wavefun…
Model reconstructions for the Si(337) orientation
F. C. Chuang, C. V. Ciobanu, C. Z. Wang +1
Although unstable, the Si(337) orientation has been known to appear in diverse experimental situations such as the nanoscale faceting of Si(112), or in the case of miscutting a Si(…
Structure and stability of the Si(105) surface
C. V. Ciobanu, V. B. Shenoy, C. Z. Wang +1
Recent experimental studies have shown that well-annealed, unstrained Si(105) surfaces appear disordered and atomically rough when imaged using scanning tunnelling microscopy (STM)…