Theoretical studies of B₂Li_n (n = 1-4)

Keyphrases

• Bridge Structure 100%
• CBS-Q 50%
• Cluster Stability 50%
• HF Method 50%
• Ionicity 50%
• Multiconfigurational Perturbation Theory 50%
• Open-shell Systems 50%
• Spin Contamination 50%
• Triangular Forms 50%

Chemistry

• CASSCF Calculation 50%
• Cohesive Energy 50%
• DFT-B3LYP Calculation 100%
• Inversion Barrier 50%
• k·p perturbation theory 50%
• Møller-Plesset Perturbation Theory 50%
• Point Group C2v 100%
• Structure 50%