German D Samolyuk

Research Staff

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SAMOLYUKGD@ORNL.GOV

All Publications

Be₂C as a neutron moderator for molten salt reactors: A first-principles study of structural, electronic, and defect properties

Transferable predictions of energetic and structural properties for refractory solid solution alloys across chemical compositions

High-performance permanent-magnet materials based on CeFe12

Spin density wave and van Hove singularity in the kagome metal CeTi3Bi4

Ab Initio Simulation of Medium-Range Ordering in Ionic Glass Electrolytes LiSiPON and LiNaSiPON

Stability Frontiers in the AM6X6 Kagome Metals: The LnNb6Sn6 (Ln:Ce–Lu,Y) Family and Density-Wave Transition in LuNb6Sn6

First-Principles Calculations of the Electrical Conductivity of Carbon Nanotubes Functionalized with Copper and Nitrogen: Implications for Electronics, Energy Storage, and Nanodevices

On the origin of magnetic anisotropy in 4f-free ferromagnets based on the CaCu5 structure *

On the origin of magnetic anisotropy in 4f-free ferromagnets based on the CaCu5 structure *...

Intricate Magnetic Landscape in Antiferromagnetic Kagome Metal TbTi3Bi4 and Interplay with Ln2–xTi6+xBi9 (Ln: Tb···Lu) Shurikagome Metals

First-principles data for solid solution niobium-tantalum-vanadium alloys with body-centered-cubic structures

Exploring Cr and molten salt interfacial interactions for molten salt applications

Solid breeder material crystal structure evolution due to Li burn up–Loss of crystal stability

Solid breeder material crystal structure evolution due to Li burn up–Loss of crystal stability

Crystallographic and temperature effects in low-energy collisions for plasma–material interactions...

Evolution of Highly Anisotropic Magnetism in the Titanium-Based Kagome Metals LnTi3Bi4 (Ln: La···Gd3+, Eu2+, Yb2+)

Native and radiation induced point defects in AlN and Sc-doped AlN

Damped Dirac magnon in the metallic kagome antiferromagnet FeSn

Potential high-performance magnet materials: Co- and Al-alloyed Sm2Fe17

Insulating antiferromagnetism in VTe...

Unusual Exchange Couplings and Intermediate Temperature Weyl State in Co3Sn2S2

First principles study of the stability and thermal conductivity of novel Li-Be hybrid ceramics

Bifunctional nanoprecipitates strengthen and ductilize a medium-entropy alloy

Equilibrium distribution of point defects in Fe-Y-O as a typical representative of nanocluster-strengthened alloys

A catastrophic charge density wave in BaFe2Al9...