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At the beginning of the 21st century, electronic-structure theory has matured to a degree that allows for accurate phase prediction and computational characterization of various kinds of materials; in particular,… Click to show full abstract
At the beginning of the 21st century, electronic-structure theory has matured to a degree that allows for accurate phase prediction and computational characterization of various kinds of materials; in particular, elemental metals adopting whatever allotropic structure, various intermetallic compounds, and other complex metal-rich phases. [...]
Keywords:
metallic compounds;
alloys metallic;
approaches metals;
metals alloys;
first principles;
principles approaches
Journal Title: Metals
Year Published: 2018
Link to full text (if available)
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Journal Title: Metals
Year Published: 2018
Link to full text (if available)
Share on Social Media: Sign Up to like & get
recommendations!