DOI: 10.1039/d6nj01656a ISSN: 1144-0546

Exceptional first hyperpolarizabilities in superalkali-functionalized Janus dimers through alkaline earth metal doping

Muhammad Sohaib, Annum Ahsan, Danish Ilyas, Hasnain Sajid, Sehrish Sarfaraz, Khurshid Ayub

In the current study, we report the design of alkaline earthides by placing superalkalis Li 3 O, Na 3 O and K 3 O on the fluorine face and alkaline earth metals (Be, Mg and Ca) on the hydrogen face of a stacked Janus (C 6 H 6 F 6 ) 2 molecule (dimer).