First-principles study of configurational disorder in using a superatom-special quasirandom structure method A Ektarawong, SI Simak, L Hultman, J Birch, B Alling
Physical Review B 90 (2), 024204, 2014
61 2014 Control of Ti1− xSixN nanostructure via tunable metal-ion momentum transfer during HIPIMS/DCMS co-deposition G Greczynski, J Patscheider, J Lu, B Alling, A Ektarawong, J Jensen, ...
Surface and Coatings Technology 280, 174-184, 2015
57 2015 Phase stabilities and vibrational analysis of hydrogenated diamondized bilayer graphenes: A first principles investigation T Pakornchote, A Ektarawong, B Alling, U Pinsook, S Tancharakorn, ...
Carbon 146, 468-475, 2019
47 2019 Stability of SnSe1− x S x solid solutions revealed by first-principles cluster expansion A Ektarawong, B Alling
Journal of Physics: Condensed Matter 30 (29), 29LT01, 2018
22 2018 Configurational order-disorder induced metal-nonmetal transition in studied with first-principles superatom-special quasirandom structure method A Ektarawong, SI Simak, L Hultman, J Birch, B Alling
Physical Review B 92 (1), 014202, 2015
22 2015 Carbon-rich icosahedral boron carbides beyond and their thermodynamic stabilities at high temperature and pressure from first principles A Ektarawong, SI Simak, B Alling
Physical Review B 94 (5), 054104, 2016
21 2016 Roles of nitrogen substitution and surface reconstruction in stabilizing nonpassivated single-layer diamond T Pakornchote, A Ektarawong, W Busayaporn, U Pinsook, ...
Physical Review B 102 (7), 075418, 2020
20 2020 Effects of configurational disorder on the elastic properties of icosahedral boron-rich alloys based on B6O, B13C2, and B4C, and their mixing thermodynamics A Ektarawong, SI Simak, L Hultman, J Birch, F Tasnádi, F Wang, B Alling
The Journal of Chemical Physics 144 (13), 2016
19 2016 First-principles prediction of stabilities and instabilities of compounds and alloys in the ternary B-As-P system A Ektarawong, SI Simak, B Alling
Physical Review B 96 (2), 024202, 2017
18 2017 Thermodynamic stability and properties of boron subnitrides from first principles A Ektarawong, SI Simak, B Alling
Physical Review B 95 (6), 064206, 2017
18 2017 Modifying Electronic and Elastic Properties of 2-Dimensional [110] Diamond by Nitrogen Substitution T Pakornchote, A Ektarawong, U Pinsook, T Bovornratanaraks
C 7 (1), 8, 2021
13 2021 Mysterious SiB3 : Identifying the Relation between α- and β-SiB3 D Eklöf, A Fischer, A Ektarawong, A Jaworski, AJ Pell, J Grins, SI Simak, ...
ACS omega 4 (20), 18741-18759, 2019
12 2019 Thermodynamic stability of hexagonal and rhombohedral boron nitride under chemical vapor deposition conditions from van der Waals corrected first principles calculations H Pedersen, B Alling, H Högberg, A Ektarawong
Journal of Vacuum Science & Technology A 37 (4), 2019
12 2019 First-principles calculation on effects of oxygen vacancy on α-MnO2 and β-MnO2 during oxygen reduction reaction for rechargeable metal-air batteries M Rittiruam, P Buapin, T Saelee, P Khajondetchairit, S Kheawhom, ...
Journal of Alloys and Compounds 926, 166929, 2022
11 2022 Role of spin-orbit coupling in the alloying behavior of multilayer solid solutions revealed by a first-principles cluster expansion A Ektarawong, T Bovornratanaraks, B Alling
Physical Review B 101 (13), 134104, 2020
11 2020 Theoretical predictions for low-temperature phases, softening of phonons and elastic stiffnesses, and electronic properties of sodium peroxide under high pressure P Jimlim, P Tsuppayakorn-aek, T Pakornchote, A Ektarawong, U Pinsook, ...
RSC advances 9 (53), 30964-30975, 2019
11 2019 High-throughput materials screening algorithm based on first-principles density functional theory and artificial neural network for high-entropy alloys M Rittiruam, J Noppakhun, S Setasuban, N Aumnongpho, A Sriwattana, ...
Scientific Reports 12 (1), 16653, 2022
10 2022 Theoretical investigation of mixing and clustering thermodynamics of Ti1− xAlxB2 alloys with potential for age-hardening E Johansson, A Ektarawong, J Rosen, B Alling
Journal of Applied Physics 128 (23), 2020
10 2020 Structural models of increasing complexity for icosahedral boron carbide with compositions throughout the single-phase region from first principles A Ektarawong, SI Simak, B Alling
Physical Review B 97 (17), 174104, 2018
10 2018 Thermodynamic stability and superconductivity of tantalum carbides from first-principles cluster expansion and isotropic Eliashberg theory P Tsuppayakorn-aek, A Ektarawong, W Sukmas, B Alling, ...
Computational Materials Science 202, 111004, 2022
7 2022