Phase transitions and suppression of magnetoresistance in WTe2-xSex system by Kanchanavatee, N., Ektarawong, A., Pakornchote, T., Alling, Björn, Hodak, S., Bovornratanaraks, T.

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Theoretical investigation of mixing and clustering thermodynamics of Ti1− x Al x B2 alloys with potential for age-hardening by Johansson, Erik, Ektarawong, Annop, Rosen, Johanna, Alling, Björn

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A comparison of the mixing thermodynamics of the antifluorite-structured Mg2Si1−xGex, Mg2Sn1−xGex and Mg2Si1−xSnx alloys from first principles by Ektarawong, A., Khamkaeo, S., Alling, B., Bovornratanaraks, T.

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Effect of chemical composition and atomic configuration on thermodynamic stability and elastic properties of AlB2-type Sc1−xVxB2 solid solutions: A first-principles investigation by Mopoung, K., Ektarawong, A., Pakornchote, T., Johansson, E., Alling, B.

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Phase stabilities and vibrational analysis of hydrogenated diamondized bilayer graphenes: A first principles investigation by Pakornchote, T., Ektarawong, A., Alling, B., Pinsook, U., Tancharakorn, S., Busayaporn, W., Bovornratanaraks, T.

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Lattice Vibrations Change the Solid Solubility of an Alloy at High Temperatures by Shulumba, Nina, Hellman, Olle, Raza, Zamaan, Alling, Björn, Barrirero, Jenifer, Mücklich, Frank, Abrikosov, Igor A, Odén, Magnus

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Thermodynamic stability and superconductivity of tantalum carbides from first-principles cluster expansion and isotropic Eliashberg theory by Tsuppayakorn-aek, P., Ektarawong, A., Sukmas, W., Alling, B., Bovornratanaraks, T.

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Vibrational free energy and phase stability of paramagnetic and antiferromagnetic CrN from ab initio molecular dynamics by Shulumba, Nina, Alling, Björn, Hellman, Olle, Mozafari, Elham, Steneteg, Peter, Odén, Magnus, Abrikosov, Igor A.

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Role of Al Vacancies in Thermodynamic Stability and Elastic Properties of AlB 2 -type (Ta,Al)B 2 : A First-Principles Study by Ektarawong, Annop, Atthapak, Chayanon, Alling, Björn

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Role of Al Vacancies in Thermodynamic Stability and Elastic Properties of AlB2${\rm AlB}_{2}$‐type (Ta,Al)B2${\rm B}_{2}$: A First‐Principles Study by Ektarawong, Annop, Atthapak, Chayanon, Alling, Björn

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Recent progress in simulations of the paramagnetic state of magnetic materials by Abrikosov, I.A., Ponomareva, A.V., Steneteg, P., Barannikova, S.A., Alling, B.

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Theoretical study of the phase transitions and electronic structure of (Zr0.5, Mg0.5)N and (Hf0.5, Mg0.5)N by Gharavi, M. A., Armiento, R., Alling, B., Eklund, P.

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Lattice relaxations in disordered Fe-based materials in the paramagnetic state from first principles by Gambino, Davide, Alling, Björn

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Stability of SnSe 1-x S x solid solutions revealed by first-principles cluster expansion by Ektarawong, A, Alling, B

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Effect of thermally excited lattice vibrations on the thermodynamic stability of tungsten ditellurides WTe2 under high pressure: A first-principles investigation by Ektarawong, A., Tsuppayakorn-aek, P., Bovornratanaraks, T., Alling, B., Kanchanavatee, N.

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A critical evaluation of GGA plus U modeling for atomic, electronic and magnetic structure of Cr2AlC, Cr2GaC and Cr2GeC by Dahlqvist, Martin, Alling, Björn, Rosén, Johanna

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Local atomic configuration approach to the nonmonotonic concentration dependence of magnetic properties of Ni2Mn1+xZ1−x (Z = In,Sn,Sb) Heusler alloys by Załęski, Karol, Ekholm, Marcus, Alling, Björn, Abrikosov, Igor A., Dubowik, Janusz

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Effect of atomic configuration and spin–orbit coupling on thermodynamic stability and electronic bandgap of monolayer 2H-Mo1−xWxS2 solid solutions by Atthapak, C, Ektarawong, A, Pakornchote, T, Alling, B, Bovornratanaraks, T

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Magnetic nanoscale laminates with tunable exchange coupling from first principles by Dahlqvist, M., Alling, B., Abrikosov, I. A., Rosen, J.

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Nitrogen vacancy, self-interstitial diffusion, and Frenkel-pair formation/dissociation in B1 TiN studied by ab initio and classical molecular dynamics with optimized potentials by Sangiovanni, D G, Alling, B, Steneteg, P, Hultman, L, Abrikosov, I A

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