Journal
PHYSICAL REVIEW B
Volume 85, Issue 2, Pages -Publisher
AMER PHYSICAL SOC
DOI: 10.1103/PhysRevB.85.024102
Keywords
-
Funding
- EPSRC
- NERC [NE/H02462X/1]
- EPSRC [EP/C546385/1] Funding Source: UKRI
- NERC [NE/H02462X/1] Funding Source: UKRI
- Engineering and Physical Sciences Research Council [EP/C546385/1] Funding Source: researchfish
- Natural Environment Research Council [NE/H02462X/1] Funding Source: researchfish
Ask authors/readers for more resources
We have calculated the lattice contribution to the electrical resistivity of body-centered-cubic iron at ambient pressure and two temperatures, 300 K and 500 K, using density functional theory and the Kubo-Greenwood formula. We performed extensive size and k-point sampling tests by including up to 1024-atom cells and up to 10 k points. The calculated resistivities fall within the range of the experimental estimates at 500 K, and overestimate it by only similar to 5% at 300 K.
Authors
I am an author on this paper
Click your name to claim this paper and add it to your profile.
Reviews
Recommended
No Data Available