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Stabilizing superconductivity of ternary metal pentahydride CaCH 5 via electronic topological transitions under high pressure from first principles evolutionary algorithm
Tsuppayakorn-aek, P.
;
Phaisangittisakul, N.
;
Ahuja, R.
;
Bovornratanaraks, T.
(
2022-05-28
)
Roles of optical phonons and logarithmic profile of electron-phonon coupling integration in superconducting Sc0.5Y0.5H6 superhydride under pressures
Sukmas, W.
;
Tsuppayakorn-aek, P.
;
Pinsook, U.
;
Ahuja, R.
;
Bovornratanaraks, T.
(
2022-05-29
)
Existence of yttrium allotrope with incommensurate host–guest structure at moderate pressure: First evidence from computational approach
Tsuppayakorn-aek, P.
;
Bovornratanaraks, T.
;
Ahuja, R.
;
Bovornratanaraks, T.
;
Luo, W.
(
2022-09-22
)
High-Pressure Structural Transformation Pathway and Electronic Properties of AgGaTe2: Ab Initio Evolutionary Structural Searching
Kotmool, K.
;
Tsuppayakorn-aek, P.
;
Luo, W.
;
Ahuja, R.
;
Bovornratanaraks, T.
(
2022-09-22
)
Electronic topological transitions and mechanical properties of hafnium dioxide allotrope at high pressure: Evolutionary first-principles techniques
Bovornratanaraks, T.
;
Ahuja, R.
;
Luo, W.
;
Tsuppayakorn-aek, P.
(
2022-12-09
)
Lattice dynamic stability and electronic structures of ternary hydrides La1 xYxH3 via first-principles cluster expansion
Tsuppayakorn-aek, P.
;
Sukmas, W.
;
Pluengphon, P.
;
Inceesungvorn, B.
;
Phansuke, P.
;
Kaewtubtim, P.
;
Ahuja, R.
;
Bovornratanaraks, T.
;
Luo, W.
(
2022-10-30
)
TM dopant-induced H-vacancy diffusion kinetics of sodium-lithium alanates: Ab initio study for hydrogen storage improvement
Pluengphon, P.
;
Tsuppayakorn-aek, P.
;
Sukmas, W.
;
Inceesungvorn, B.
;
Ahuja, R.
;
Bovornratanaraks, T.
(
2022-07-19
)
Superconducting Gap of Pressure Stabilized (Al0.5Zr0.5)H3 from Ab Initio Anisotropic Migdal−Eliashberg Theory
Tsuppayakorn-aek, P.
;
Bovornratanaraks, T.
;
Ahuja, R.
(
2022-09-27
)
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Author
Ahuja, R. (8)
Bovornratanaraks, T. (8)
Tsuppayakorn-aek, P. (8)
Luo, W. (4)
Sukmas, W. (3)
Inceesungvorn, B. (2)
Pluengphon, P. (2)
Kaewtubtim, P. (1)
Kotmool, K. (1)
Phaisangittisakul, N. (1)
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Subject
High pressure (2)
Structural prediction (2)
Bandwidth function (1)
cluster expansion (1)
Complex hydride (1)
Density functional theory (1)
Diffusion kinetics (1)
Doped compound (1)
Electronic topological transitions (1)
Hafnium dioxide (1)
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Date Issued
2022 (8)