Elumalai Varathan (E Varathan)

ResearcherID ORCID

Publication Activity (10 Years)

Years Active: 2019-2024
Publications (10 Years): 26

Top Topics

Molecular Dynamics

Aqueous Solution

Density Functional Theory

Transition Metal

Top Venues

Inorganic chemistry

Physical chemistry chemical physics : PCCP

The journal of physical chemistry. A

Dalton transactions (Cambridge, England : 2003)

This page only lists publications with an associated author ORCID identifier.

Publications

Mani Balamurugan, Jun Ho Jang, Jeong Eun Kim, Won Il Choi, Young In Jo, Sunghak Park, Elumalai Varathan, Ki Tae Nam
Tuning the CO 2 Reduction Selectivity of an Immobilized Molecular Ag Complex beyond CO. Inorganic chemistry 63 (17) (2024)
Mani Balamurugan, Jun Ho Jang, Jeong Eun Kim, Won Il Choi, Young In Jo, Sunghak Park, Elumalai Varathan, Ki Tae Nam
Tuning the CO 2 Reduction Selectivity of an Immobilized Molecular Ag Complex beyond CO. Inorganic chemistry (2024)
K Rama Swami, N Parvathy, Abigail Jennifer G, Ramesh L Gardas, Elumalai Varathan
Elucidation of the extraction of trivalent actinides using the DOHyA-HDEHP system: an experimental and theoretical approach. Physical chemistry chemical physics : PCCP (2024)
Masiyappan Karuppusamy, Shyam Vinod Kumar Panneer, Elumalai Varathan, Mahesh Kumar Ravva, Niraikulam Ayyadurai, Venkatesan Subramanian
Design of Isoindigo-Based Small-Molecule Donors for Bulk Heterojunction Organic Solar Cell Applications in Combination with Nonfullerene Acceptors. The journal of physical chemistry. A (2024)
Abigail Jennifer G, Georg Schreckenbach, Elumalai Varathan
Computational study of core modified dipyriamethyrin for the competitive complexation of Am 3+ /Cm 3+ from their trichlorides. Dalton transactions (Cambridge, England : 2003) 53 (18) (2024)
K Rama Swami, N Parvathy, Abigail Jennifer G, Ramesh L Gardas, Elumalai Varathan
Elucidation of the extraction of trivalent actinides using the DOHyA-HDEHP system: an experimental and theoretical approach. Physical chemistry chemical physics : PCCP 26 (17) (2024)
Masiyappan Karuppusamy, Shyam Vinod Kumar Panneer, Elumalai Varathan, Mahesh Kumar Ravva, Niraikulam Ayyadurai, Venkatesan Subramanian
Design of Isoindigo-Based Small-Molecule Donors for Bulk Heterojunction Organic Solar Cell Applications in Combination with Nonfullerene Acceptors. The journal of physical chemistry. A 128 (21) (2024)
Abigail Jennifer G, Georg Schreckenbach, Elumalai Varathan
Computational study of core modified dipyriamethyrin for the competitive complexation of Am 3+ /Cm 3+ from their trichlorides. Dalton transactions (Cambridge, England : 2003) (2024)
K Rama Swami, N Parvathy, Abigail Jennifer G, Ramesh L Gardas, Elumalai Varathan
Elucidation of the extraction of trivalent actinides using the DOHyA-HDEHP system: an experimental and theoretical approach. Physical chemistry chemical physics : PCCP 26 (17) (2024)
Abigail Jennifer G, Elumalai Varathan
High-valent actinyl (AnO 2 ; An = U, Np and Pu) complexation with TEtraQuinoline (TEQ) ligand - a DFT study. Physical chemistry chemical physics : PCCP (2024)
Yang Gao, Abigail Jennifer G, Elumalai Varathan, Georg Schreckenbach
Understanding the Coordination Chemistry of Am III /Cm III in the DOTA Cavity: Insights from Energetics and Electronic Structure Theory. Inorganic chemistry 62 (7) (2023)
Priya Rana, Abigail Jennifer G, Shanmuka Rao T, Dr Sabyasachi Mukhopadhyay, Elumalai Varathan, Priyadip Das
Polarity-Induced Morphological Transformation with Tunable Optical Output of Terpyridine-Phenanthro[9,10- d ]imidazole-Based Ligand and Its Zn(II) Complexes with I - V Characteristics. ACS omega 8 (51) (2023)
Priya Rana, Abigail Jennifer G, Shanmuka Rao T, Dr Sabyasachi Mukhopadhyay, Elumalai Varathan, Priyadip Das
Polarity-Induced Morphological Transformation with Tunable Optical Output of Terpyridine-Phenanthro[9,10- d ]imidazole-Based Ligand and Its Zn(II) Complexes with I - V Characteristics. ACS omega 8 (51) (2023)
Abigail Jennifer G, Yang Gao, Georg Schreckenbach, Elumalai Varathan
Periodic Trends in the Stabilization of Actinyls in Their Higher Oxidation States Using Pyrrophen Ligands. Inorganic chemistry 62 (18) (2023)
Silda Peters, Elumalai Varathan, Renjith S Pillai
Investigation of Guest-Induced Flexibility in Pyrazine Derivative of ALFFIVE MOF via Molecular Simulation. Langmuir : the ACS journal of surfaces and colloids 39 (4) (2023)
Abigail Jennifer G, Yang Gao, Georg Schreckenbach, Elumalai Varathan
Periodic Trends in the Stabilization of Actinyls in Their Higher Oxidation States Using Pyrrophen Ligands. Inorganic chemistry 62 (18) (2023)
Abigail Jennifer G, Yang Gao, Georg Schreckenbach, Elumalai Varathan
Periodic Trends in the Stabilization of Actinyls in Their Higher Oxidation States Using Pyrrophen Ligands. Inorganic chemistry (2023)
Yang Gao, Abigail Jennifer G, Elumalai Varathan, Georg Schreckenbach
Understanding the Coordination Chemistry of Am III /Cm III in the DOTA Cavity: Insights from Energetics and Electronic Structure Theory. Inorganic chemistry (2023)
Silda Peters, Elumalai Varathan, Renjith S Pillai
Investigation of Guest-Induced Flexibility in Pyrazine Derivative of ALFFIVE MOF via Molecular Simulation. Langmuir : the ACS journal of surfaces and colloids (2023)
Mathiyazhagan Sivanantham, Abigail Jennifer G, Elumalai Varathan, Mohankumar Ramasamy, Gopal Chandru Senadi
Iodo-sulphonylation of 1,6-enynones: a metal-free strategy to synthesize N -substituted succinimides. Organic & biomolecular chemistry 20 (40) (2022)
Abigail Jennifer G, Yang Gao, Georg Schreckenbach, Elumalai Varathan
Chemical bonding in actinyl(V/VI) dipyriamethyrin complexes for the actinide series from americium to californium: a computational investigation. Dalton transactions (Cambridge, England : 2003) 51 (26) (2022)
Shanthini Priscilla A, Silda Peters, Cheriyan Ebenezer, Elumalai Varathan, Rajadurai Vijay Solomon
Why trans and not cis ? - Molecular dynamics and DFT study on selective separation of dihaloethene isomers using perethylated pillar[5]arene. Physical chemistry chemical physics : PCCP 24 (36) (2022)
Yang Gao, Elumalai Varathan, Payal Grover, Georg Schreckenbach
Computational Characterization of AcIII-DOTA Complexes in Aqueous Solution. Inorganic chemistry 60 (10) (2021)
Elumalai Varathan, Yang Gao, Georg Schreckenbach
Computational Study of Actinyl Ion Complexation with Dipyriamethyrin Macrocyclic Ligands. The journal of physical chemistry. A 125 (4) (2021)
Raghavendra Venkatraman, Shyam Vinod Kumar Panneer, Elumalai Varathan, Venkatesan Subramanian
Aromaticity-Photovoltaic Property Relationship of Triphenylamine-Based D-π-A Dyes: Leads from DFT Calculations. The journal of physical chemistry. A 124 (17) (2020)
Elumalai Varathan, Archita Patnaik
Oxidation State-Dependent Electronic Properties of Sulfur-Containing Thermally Activated Delayed Fluorescence Molecules. The journal of physical chemistry. A 123 (41) (2019)