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Publications (12)
- DFT‐Based Computational Approach for Structure and Design of Materials: The Unfinished Story Save
- DFT-Based Computational Approach for Structure and Design of Materials: The Unfinished Story Save
- First-Principles Characterization of Noncovalent Interactions in the Enantioselective Oxetane Ring Opening via SPHENOL-Based Chiral Phosphoric Acid Catalyst Save
- Noncovalent Interactions, Structure Elucidation and Docking Studies of anti-Fungal Pyridine Carboxamide Derivatives of Co(II), Ni(II), Cu(II) & Zn(II) Save
- The curious case of co-planarity in di-nuclear triel complexes: a density functional investigation Save
- Asymmetric catalysis by l-prolinamide based small molecules: synthesis, characterization and first principle studies on their enantioselectivity Save
- Ligand and Substituent Effect on Regium−π Bonding in Cu and Ag π-Conjugated Complexes: A Density Functional Study Save
- Cooperative Effect of Noncovalent Interactions on Tetrel Bonding in Halogenated Silanes Save
- Coordination compound containing σ-hole interactions: Synthesis and crystal structure of NH4[Cr(CO(NH2)2)6][Hg(SCN)4]2·2H2O Save
- Mononuclear Pseudostannatranes Possessing Unsymmetrical [4.4.3.01,5]Tridecane Cage: Experimental and Theoretical Aspects of Reverse Kocheshkov Reaction in Phenyl Pseudostannatrane Save