Blog Archives

When Does Gold Behave as a Halogen? Predicted Uranium Tetraauride and Other Mau₄ Tetrahedral Species, (M = Ti, Zr, Hf, Th)

On the reaction of a uranium atom with a nitrogen molecule: a theoretical attempt

Predicted Group 4 Tetra-azides M(N₃)₄ (M = Ti−Hf, Th):  The First Examples of Linear M−NNN Coordination

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