Cover Image. - Sai Manoj N. V. T. Gorantla; Pattiyil Parameswaran; Kartik Chandra Mondal (J. Comput. Chem., 2021)

Stabilization of group 14 elements E = C, Si, Ge by hetero-bileptic ligands cAAC, MCOn with push-pull mechanism. - Sai Manoj N. V. T. Gorantla; Pattiyil Parameswaran; Kartik Chandra Mondal (J. Comput. Chem., 2021)

Dative quadruple bonds between d10 transition metals and beryllium in BeM(PMe3)2 and BeM(CO)2 (M = Ni, Pd, and Pt) complexes: Transition metal fragments as six-electron donor and two-electron acceptor. - Sneha Parambath; Vishnu Thannimangalath; Pattiyil Parameswaran (J. Comput. Chem., 2023)

σ versus π-radical: Tuning the electronic nature of neutral carbon (I) compounds with three non-bonding electrons. - Puthan Veetil Muhasina; Pattiyil Parameswaran (J. Comput. Chem., 2023)