Keyphrases
Multiconfigurational
100%
Self-consistent Field Theory
100%
Density Matrix
100%
Active Space
100%
Matrix Embedding
100%
Self-consistent Field Methods
100%
Density Matrix Embedding Theory
77%
Wave Function
44%
Self-consistent Field
22%
Complete Active Space Self-consistent Field (CASSCF)
22%
Multiconfigurational Wavefunction
22%
Active Subspace
22%
Cost Scaling
22%
Quantum Mechanical
11%
Strong Correlation
11%
Function-based
11%
Realistic Model
11%
Potential Energy Curves
11%
Large Systems
11%
Theory Calculation
11%
Double Bond
11%
Embedding Method
11%
Diazene
11%
Attractive Alternatives
11%
Wavefunction Methods
11%
Error Function
11%
Bond Dissociation
11%
Perturbative Treatment
11%
Variational Wave Function
11%
Coupled Subsystems
11%
Space Wave
11%
Second Quantization
11%
Function Minimization
11%
Mechanical Embedding
11%
Chemistry
Hartree-Fock Calculation
100%
Density Matrix
100%
Field Theory
100%
Wave Function
87%
CASSCF Calculation
25%
Diazene
12%
Potential Energy
12%
Double Bond
12%