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College of Science
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Chemistry
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dissertation
4
Subject
Density functional theory
4
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Subject:
"Density functional theory"
Collection:
"ir_etd"
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Title
Setname
Type
1
Enhancements to the modified genetic algorithm for crystal structure prediction
ir_etd
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
ir_etd
Text
3
Guided ion beam tandem mass spectrometer and theoretical studies of third-row transition metal ions Hf+, Ta+, W+, and Os+
ir_etd
Text
4
Quantum mechanics and experimental solid-state nuclear magnetic resonance analysis of strained molecular systems
ir_etd
Text
1
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25
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4