Engineering & Materials Science
Density functional theory
100%
Atoms
53%
Transition metals
44%
Energy gap
43%
Lithium
38%
Spintronics
34%
Semiconductor materials
33%
Phase transitions
33%
Phonons
32%
Nanosheets
31%
Metals
28%
Ground state
25%
Electronic properties
25%
Crystalline materials
24%
Monolayers
24%
Photocatalysts
24%
Spin orbit coupling
24%
High-entropy alloys
24%
Anodes
24%
Cathodes
23%
Graphene
23%
Lithium sulfur batteries
22%
Crystals
22%
Electronic structure
22%
Magnetism
21%
Solvation
21%
Charge density waves
20%
Heterojunctions
20%
Electrons
19%
Alloying
18%
Hydrogen evolution reaction
17%
Oxygen evolution reaction
17%
Carbon nanotubes
17%
Sulfur
17%
Interfacial energy
17%
Doping (additives)
17%
Temperature
16%
Magnetic semiconductors
16%
Machine learning
16%
Electrolytes
16%
Characterization (materials science)
16%
Intermetallics
16%
Ions
16%
Chalcogenides
15%
Functional assessment
15%
Anisotropy
15%
Defects
15%
Chemical vapor deposition
14%
Oxygen vacancies
14%
Valence bands
13%
Chemical Compounds
Semiconductor
39%
Energy
39%
Band Gap
39%
Alloy
38%
Density Functional Theory
36%
Application
29%
Spintronics
27%
Phonon
24%
Cathode
22%
Anisotropy
20%
Spin-Orbit Coupling
19%
Monolayer
18%
Alloying
18%
Anode
18%
Metal
17%
Electronic Property
17%
Intermetallic Compound
17%
Nanosheet
17%
Transition Element
17%
Magnetism
16%
Antiferromagnetic
15%
Interfacial Energy
15%
Ductility
15%
Simulation
15%
Graphene
14%
Charge Density Wave
14%
Surface
13%
Electronic State
13%
Antiferromagnetic Ordering
12%
Carbon Nanotube
12%
Strain
11%
Solvation
11%
Etching
10%
Curie Temperature
10%
Piezoelectricity
9%
Dioxygen
9%
Electron Spin
9%
Grain Boundary
9%
Nonconductor
9%
Ground State
9%
Chalcogen
9%
Energy Storage
9%
Pyrite
8%
Chemical Vapour Deposition
8%
Piezoelectric Coefficient
8%
Disorder
8%
Antiferromagnetism
7%
Hexagonal Space Group
7%
Bias Potential
7%
Condensed-Matter Physics
7%
Physics & Astronomy
density functional theory
42%
predictions
19%
orbitals
18%
characterization
18%
energy of formation
17%
electronics
17%
transition metals
17%
carbon nanotubes
15%
graphene
14%
atoms
14%
machine learning
12%
engineering
12%
synthesis
11%
energy
11%
electronic structure
11%
rocks
10%
ductility
10%
pyrites
10%
lithium
10%
metals
10%
defects
10%
functionals
10%
intermetallics
9%
electric batteries
9%
entropy
9%
Wales
9%
water splitting
9%
Group 5A compounds
9%
magnesium
8%
surface energy
8%
solvation
8%
interactions
8%
phonons
8%
routes
8%
boron
8%
lithium sulfur batteries
8%
vapor deposition
8%
cathodes
8%
anisotropy
7%
magnesium alloys
7%
nanotubes
7%
catalytic activity
7%
aluminum
6%
alloying
6%
ground state
6%
hexagons
6%
control surfaces
6%
aluminum alloys
6%
phosphides
6%
geometry
6%