Consistent van der Waals radii for the whole main group
M Mantina, AC Chamberlin, R Valero… - The Journal of …, 2009 - ACS Publications
Atomic radii are not precisely defined but are nevertheless widely used parameters in
modeling and understanding molecular structure and interactions. The van der Waals radii …
modeling and understanding molecular structure and interactions. The van der Waals radii …
Structural and electronic properties of neutral and anionic magnesium clusters doped with two barium atoms
QY Li, YF Hu, SG ** on the geometrical structures, stability, and electronic and spectral properties of magnesium clusters: DFT study of SiMgn (n = 1‐12) …
BC Zhu, S Zhang, L Zeng - International Journal of Quantum …, 2020 - Wiley Online Library
Using the density functional theory (DFT) method at the B3LYP/6− 311G (D) level, we
studied how silicon do** affects the geometrical structure, stability, and electronic and …
studied how silicon do** affects the geometrical structure, stability, and electronic and …
Rapid 3D roll-up of gas-phase planar gold clusters and affinity and alienation for Mg and Ge: A theoretical study of MgGeAun (n= 1–12) clusters
BC Zhu, PJ Deng, J Guo, WB Kang, L Bao - Iscience, 2022 - cell.com
A cluster is a special matter level above a single atom and between macroscopic and
microscopic matter, and it is an important bridge to understanding the relationship between …
microscopic matter, and it is an important bridge to understanding the relationship between …
Diatomic molecules of alkali-metal and alkaline-earth-metal atoms: interaction potentials, dipole moments, and polarizabilities
Ultracold diatomic molecules find application in quantum studies ranging from controlled
chemistry and precision measurement physics to quantum many-body simulation and …
chemistry and precision measurement physics to quantum many-body simulation and …