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"Density functional theory"
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1953
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Title
Date
Type
1
Enhancements to the modified genetic algorithm for crystal structure prediction
2016
Text
2
First-principles density functional theory study to aid understanding of the effects of doping-induced defects in materials used for solid oxide fuel cells
2014-08
Text
3
Guided ion beam tandem mass spectrometer and theoretical studies of third-row transition metal ions Hf+, Ta+, W+, and Os+
2013-08
Text
4
Quantum mechanics and experimental solid-state nuclear magnetic resonance analysis of strained molecular systems
2011-12
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