Molecular Physics Structure and dynamics of HD+ in the vicinity of the H+ + D and D+ + H dissociation thresholds: Feshbach resonances and the role of g/u-symmetry breaking. By Maximilian Beyer, 3 years ago
Molecular Physics A density functional theory study of the simplest adsorption forms of perfluorooctanoic and perfluorooctanesulphonic acids by graphene oxide and fluorinated graphene oxide*. By Leonid Gorb, 3 years ago
Molecular Physics Cavity ring down spectroscopy of water vapour near 750 nm: a test of the HITRAN2020 and W2020 line lists. By S. Vasilchenko, 3 years ago
Molecular Physics Application of chromium-silicon cluster for selective removal of arsenic and sulfide from wastewater. By Afshan Mohajeri, 3 years ago
Molecular Physics Partial-wave decomposition of the one-electron properties of the LiH molecule computed with explicitly correlated basis sets. By Krzysztof Strasburger, 3 years ago
Molecular Physics Systematic study of phase transformation, wide-to-narrow electronic band transition and optical properties of barium zirconium Oxynitrate: Ab initio calculations. By S. S. A. Gillani, 3 years ago
Molecular Physics Geometry, absorption and luminescence of small Ar clusters. By Mukul Dhiman, 3 years ago
Molecular Physics Ultraprecise relative energies in the (2 0 0) vibrational band of H216O. By Meissa L. Diouf, 3 years ago
Molecular Physics Calculations of atomisation energy and singlet–triplet gap with iterative multireference configuration interaction. By Jia-Qi Fan, 3 years ago
Molecular Physics On the size consistency problem for anti-symmetrised geminal power wave function ansatz. By L. K. Sørensen, 3 years ago