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Keyword [first principles calculation]
Result: 41 - 60 | Page: 3 of 4
41.
A First-Principle Study On The Effect Of A-site Doping And Substituting On Structure Of Perovskite Materials
42.
First-principles Study Of Ce-doped NdFeB Magnets And Its Heat Treatment Experiment
43.
Compressive Structural Phase Transition And Photoelectric Properties Of Perovskite Material CH
3
NH
3
PbI
3
44.
Theoretical Investigations On The Absorption Of Materials For Intermediate Band Solar Cell:based On First Principles
45.
The Effects Of Lithium Components On Physical And Chemical Properties Of High Z First Wall Materials In Nuclear Fusion Plant
46.
First Principle Study Of Organic Materials Under High Pressure
47.
The Structures,Electronic Structures And Na-ion Diffusion Dynamics In Mn-Based Cathode Materials For Na-ion Batteries:A First-principles Study
48.
Effect Of Zn
1-x
Mg
x
O Window Layers On The Performance Of Cu
2
ZnSn(S,Se)
4
Solar Cells
49.
Credibility Evaluation Of First-principles Calculation Method In Lithium Ion Battery Materials Applications
50.
Study Of Perovskite Solar Cells Based On Different Passivation Layers
51.
Theoretical Study Of Two-dimensional Metal Compound Electronic Devices
52.
The First-Principle Study On Nontoxic Gold-based Perovskite Solar Cells Absorbers
53.
High-throughput Screening Of Chalcogenide Perovskite Photovoltaic Materials
54.
Structural Degradation And Doping Modification Of Nickel-based Layered Cathode Materials For Lithium/Sodium Ion Batteries
55.
Properties Study And Design Of Perovskites For Solar Cells And Water-Splitting Electrocatalysts
56.
The Behavior Of Hydrogen And Helium In Heterogeneous Interfaces
57.
First Principles Calculation Of Defect Evolution And Structural Characteristics Of W-based Alloys For First Wall Materials
58.
Study On The Coupling Effect And Mechanism Of Irradiated Oxidation Of Iron-based Nuclear Structural Materials
59.
First-principles Study On The Electronic Structure Of Antimony/bismuth Single-layer Two-dimensional Topological Materials
60.
Phase Structure And Magnetic Properties Of Rare-Earth Free MnAl Based Permanent Magnet Alloys
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