Chemistry
Energy
100%
Procedure
88%
Molecule
76%
Core Level
71%
Binding Energy
71%
Density Functional Theory
63%
Atom
49%
Particle Size
43%
Electron Particle
42%
Gaussian
41%
Simulation
38%
Solid
37%
Liquid
36%
Quasiparticle
35%
Application
35%
Quantum Mechanics
35%
Base
32%
Electronic State
31%
Correlation
29%
Water Type
29%
Tight Binding Model
28%
Plane Wave
28%
Orbital
27%
Concentration
26%
Spectroscopy
24%
Adsorption
22%
Hybrid Functionals
22%
Pseudopotential
22%
Crystalline Material
22%
Error
21%
Molecular Dynamics
21%
Organic Molecule
20%
Valence
19%
Many-Body Perturbation Theory
19%
NMR Spectroscopy
17%
Photoelectron Spectroscopy
17%
Boron Nitride
17%
Thermodynamic Property
17%
Surface
17%
Transport Property
17%
Configuration Interaction
17%
Density
17%
Carbon
17%
Wetting
17%
Ionic Liquid
17%
Liquid Film
14%
Cation
14%
Band Gap
13%
Condensed Phase
12%
Spectra
11%
Physics
Molecules
53%
Calculation
51%
Electrons
42%
Substrates
35%
Cores
35%
Quantum Mechanics
35%
Binding Energy
35%
Atoms
34%
Adsorption
33%
Density Functional Theory
31%
Water
29%
Orbitals
26%
Correction
24%
Electronic Structure
24%
Simulation
23%
Machine Learning
20%
Multiple Mirror Telescope
19%
Quantum Dot
17%
Nanosheet
17%
Liquid State
17%
Thin Film Growth
17%
Crystals
17%
Images
17%
Atomic Structure
17%
Wetting
17%
Nuclear Magnetic Resonance
17%
Solid State
16%
Approximation
14%
Quasiparticle
14%
Molecular Dynamics
14%
Electrostatics
13%
Deviation
13%
Liquids
11%
Perturbation Theory
11%
Scanning Tunneling Microscopy
11%
Terms
10%
Plane Wave
10%
Metal Interface
8%
Growth
8%
Density of States
8%
Ionization Potential
8%
Gases
8%
Heterojunctions
8%
Frequencies
8%
Sites
8%
Domains
8%
Nanoscale
8%
Graphene
8%
Geometry
7%
Performance
5%
Computer Science
Algorithms
45%
Accuracy
33%
Application
26%
Computational Cost
25%
Density Functional Theory
24%
Simulation
23%
Electronics
22%
Binding Energy
17%
Software Package
17%
Benchmark
17%
Structure Calculation
17%
Evaluation
17%
Computing
16%
Absolute Deviation
13%
Approximation (Algorithm)
12%
Parallel Execution
12%
Scanning Tunneling Microscopy
8%
Supercomputer
8%
Domains
8%
Density of State
8%
Base Type
8%
Functions
5%