Blog Archives

The ground state and electronic spectrum of CUO: a mystery

The Electronic Spectrum of Re₂Cl₈^2-:  A Theoretical Study

Theoretical Study of the Lowest ¹B_U States of trans-Stilbene

Torsional potential energy surfaces and vibrational levels in trans Stilbene

New Group 2 Chemistry:  A Multiple Barium−Nitrogen Bond in the CsNBa Molecule

η⁵-N₅^– −Metal−η⁷-N₇^3-:  A New Class of Compounds

Coordination of the Neptunyl Ion with Carbonate Ions and Water:  A Theoretical Study

A theoretical study of the 2¹Ag ← 1¹Ag two-photon transition and its vibronic band in trans-stilbene

On the Electronic Structure of the UO₂ Molecule

Scandium Cycloheptanitride, ScN₇:  A Predicted High-Energy Molecule Containing an [η⁷-N₇]^3- Ligand