[HTML][HTML] Efficient predictions of formation energies and convex hulls from density functional tight binding calculations

A Kumar, ZA Ali, BM Wong - Journal of Materials Science & Technology, 2023 - Elsevier
Defects in materials significantly alter their electronic and structural properties, which affect
the performance of electronic devices, structural alloys, and functional materials. However …

Efficient Predictions of Formation Energies and Convex Hulls from Density Functional Tight Binding Calculations

A Kumar, ZA Ali, B Wong - Available at SSRN 4167651 - papers.ssrn.com
Defects in materials significantly alter their electronic and structural properties, which affect
the performance of electronic devices, structural alloys, and functional materials. However …

Efficient predictions of formation energies and convex hulls from density functional tight binding calculations

A Kumar, ZA Ali, BM Wong - Journal of Materials Science and Technology, 2023 - osti.gov
Efficient predictions of formation energies and convex hulls from density functional tight binding
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[PDF][PDF] Efficient predictions of formation energies and convex hulls from density functional tight binding calculations

A Kumar, ZA Ali, BM Wong - Journal of Materials Science & …, 2023 - dranshuman.me
abstract Defects in materials significantly alter their electronic and structural properties,
which affect the performance of electronic devices, structural alloys, and functional materials …

Efficient predictions of formation energies and convex hulls from density functional tight binding calculations

A Kumar, ZA Ali, BM Wong - Journal of Materials Sciences and Technology, 2023 - jmst.org
Defects in materials significantly alter their electronic and structural properties, which affect
the performance of electronic devices, structural alloys, and functional materials. However …

Efficient predictions of formation energies and convex hulls from density functional tight binding calculations

A Kumar, ZA Ali, BM Wong - Journal of Materials Sciences and Technology, 2023 - jmst.org
Defects in materials significantly alter their electronic and structural properties, which affect
the performance of electronic devices, structural alloys, and functional materials. However …