Dr Rohini K

Dr Rohini K

Designation: Asst.Professor
EducationMSc, PhD.
Professional Experience
Teaching    : 5
Research   : 5

UG : Chemistry (MG University)
PG : Chemistry (MG University)
Ph.D : Theoretical Chemistry ( Indian Institute of Science Education & Research)


  1. Host–Guest Interactions in the Confined Geometries Formed from Molecular Aggregates of Push–Pull Molecules. J. Phys. Chem. A 2013, 117, 5794-5801.
  2. Rohini K, Daniel M. R. Sylvinson, and R. S. Swathi, Intercalation of HF, H2O, and NH3 Clusters within the Bilayers of Graphene and Graphene Oxide: Predictions from Coronene-Based Model Systems. J. Phys. Chem. A 2015, 119, 10935-10945.
  3. Rohini K and R. S. Swathi, Tunable Azacrown-Embedded Graphene Nanomeshes for Ion Sensing and Separation. ACS Appl. Mater. Interfaces 2017, 9, 999-1010.


  • Workshop on Introduction to Gaussian: Theory and Practise at CLRI and IIT Madras (January, 2012).
  • 14th National Symposium in Chemistry at NIIST, Trivandrum (February, 2012).
  • International Conference on Electronic Structure and Dynamics of Molecules and Clusters (ESDMC) at IACS, Kolkata (February, 2013).
  • Conference on Current Trends in Theoretical Chemistry (CTTC) at BARC, Mumbai (September, 2013).
  • 8th Asian Photochemistry Conference (APC), IISER Trivandrum and NIIST Trivandrum (November, 2014).
  • Workshop on High Performance Scientific Computing at IISER Trivandrum (June, 2016).
  • 12th JNC Research Conference on Chemistry of Materials at Taj Vivanta, Kovalam (September, 2016).

Research Interest

  • Theoretical Chemistry
  • Energetics of reactions