Physics & Astronomy
Monte Carlo method
89%
molecules
85%
electronic structure
81%
oxygen
77%
atoms
77%
simulation
75%
electrons
62%
porphyrins
57%
electronics
56%
density functional theory
53%
tin
51%
dioxides
49%
quantum statistics
46%
silicon
46%
estimators
45%
wurtzite
45%
approximation
42%
shift
41%
orbitals
40%
temperature
39%
dissociation
39%
reactivity
37%
adsorption
37%
electron transfer
35%
damping
33%
ground state
33%
gases
32%
multipoles
32%
zinc
31%
vibration
29%
thermal dissociation
29%
molecular dynamics
29%
excitation
28%
pseudopotentials
27%
dyes
27%
solid state
27%
energy
26%
hydrogen
26%
geometry
25%
rutile
25%
temperature distribution
24%
lasers
24%
temperature effects
24%
nuclei
24%
sampling
23%
photoelectrons
23%
tensors
23%
chemisorption
22%
evaluation
22%
functionals
21%
Engineering & Materials Science
Electrons
98%
Density functional theory
97%
Oxygen
80%
Atoms
80%
Adsorbates
75%
Surface relaxation
62%
Local density approximation
57%
Tin dioxide
51%
Electronic structure
49%
Photoelectrons
47%
Electronic density of states
40%
Oxygen vacancies
40%
Monte Carlo methods
36%
Adsorption
35%
Temperature
35%
Ions
33%
Silicon
32%
Chemical vapor deposition
32%
Lasers
31%
Molecular dynamics
31%
Semiconductor materials
30%
Structural properties
30%
Substrates
28%
Surface plasmon resonance
27%
Physisorption
26%
Molecular vibrations
26%
Desorption
26%
Hot Temperature
26%
Silanes
25%
Photoemission
25%
Plasmons
24%
Molecular oxygen
24%
Biological membranes
24%
Computer simulation
24%
Membrane Lipids
24%
Crystals
24%
Tin oxides
24%
Phospholipids
22%
Thermal desorption
22%
Chemical sensors
22%
Electronic properties
21%
Amorphous carbon
21%
Damping
21%
Geometry
20%
Methanation
20%
Quantum theory
20%
Silver nanoparticles
20%
Gases
19%
Band structure
19%
X rays
18%
Chemical Compounds
Simulation
100%
Molecular Cluster
75%
Surface
71%
Molecular Dynamics
63%
Auger Electron Spectrum
62%
Density Functional Theory
53%
Surface Relaxation
46%
Meso-Substituted Porphyrin
45%
Path Integral
42%
Dioxygen
41%
Electronic State
40%
Tin Dioxide
39%
Local-Density Approximation
39%
Porphyrin
35%
Energy
35%
Polarizability
34%
Dissociation
33%
Silane
33%
Density of State
32%
Electron-Hole Pair
30%
Multipole
29%
Molecule
28%
Rutile
27%
Semiconductor
27%
Kinetic Energy
24%
Schottky Barrier
23%
Monte Carlo Method
23%
Phospholipid
23%
Nodularin
23%
Photoelectron Spectrum
21%
Electron Transfer
21%
Spin-Spin Coupling
19%
Lipid
19%
Photoelectron
19%
Diatomic Molecule
18%
Molecular Vibration
18%
Diborane
18%
Polycrystalline Solid
18%
Tin Oxide
18%
Gas
18%
Carbon Monoxide
18%
Heat
18%
Structure Parameter
17%
Atomic Orbital
17%
Epitaxial Growth
16%
Chemical Shift
16%
Internal Rotation
16%
Molecular Beam
16%
Electronic Transition
16%
Resonance
16%