1. A study of the Group 1 metal tetra-aza macrocyclic complexes [M(Me4cyclen)(L)]+ using electronic structure calculations. Issue 44 (25th October 2017) Authors: Bhakhoa, Hanusha; Rhyman, Lydia; Lee, Edmond P.; Mok, Daniel K. W.; Ramasami, Ponnadurai; Dyke, John M. Journal: Dalton transactions Issue: Volume 46:Issue 44(2017) Page Start: 15301 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
2. A theoretical study of the hydrolysis mechanism of A-234; the suspected novichok agent in the Skripal attack. Issue 47 (27th July 2020) Authors: Imrit, Yadhav A.; Bhakhoa, Hanusha; Sergeieva, Tetiana; Danés, Sergi; Savoo, Nandini; Elzagheid, Mohamed I.; Rhyman, Lydia; Andrada, Diego M.; Ramasami, Ponnadurai Journal: RSC advances Issue: Volume 10:Issue 47(2020) Page Start: 27884 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
3. Aza-macrocyclic complexes of the Group 1 cations – synthesis, structures and density functional theory study1. Issue 31 (21st August 2015) Authors: Dyke, John; Levason, William; Light, Mark E.; Pugh, David; Reid, Gillian; Bhakhoa, Hanusha; Ramasami, Ponnadurai; Rhyman, Lydia Journal: Dalton transactions Issue: Volume 44:Issue 31(2015) Page Start: 13853 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
4. Can Cyclen Bind Alkali Metal Azides? A DFT Study as a Precursor to Synthesis1. Issue 13 (16th February 2016) Authors: Bhakhoa, Hanusha; Rhyman, Lydia; Lee, Edmond P. F.; Ramasami, Ponnadurai; Dyke, John M. Journal: Chemistry Issue: Volume 22:Issue 13(2016) Page Start: 4469 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
5. Copper(I)-catalysed regioselective synthesis of pyrazolo[5, 1-c]-1, 2, 4-triazoles: A DFT mechanistic study. Issue 31 (3rd August 2017) Authors: Hallooman, Dhanashree; Bhakhoa, Hanusha; Ríos-Gutiérrez, Mar; Rhyman, Lydia; Oliferenko, Alexander A.; Katritzky, Alan R.; Alswaidan, Ibrahim A.; Elzagheid, Mohamed I.; Domingo, Luis R.; Ramasami, Ponnadurai Journal: Tetrahedron Issue: Volume 73:Issue 31(2017) Page Start: 4653 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
6. Photophysical, electrochemical, and DFT studies of the novel azacrown-bridged dinuclear ruthenium dye sensitizers for solar cells. (15th November 2019) Authors: Uahengo, Veikko; Cai, Ping; Naimhwaka, Johannes; Rahman, Ateeq; Daniel, Likius S.; Bhakhoa, Hanusha; Rhyman, Lydia; Ramasami, Ponnadurai Journal: Polyhedron Issue: Volume 173(2019) Page Start: Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
7. Theoretical study of the molecular aspect of the suspected novichok agent A234 of the Skripal poisoning. Issue 2 (6th February 2019) Authors: Bhakhoa, Hanusha; Rhyman, Lydia; Ramasami, Ponnadurai Journal: Royal Society open science Issue: Volume 6:Issue 2(2019) Page Start: Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗