Moumita Majumder

Automated construction of potential energy surfaces

Moumita Majumder, Steve Ndengué, Richard Dawes · Molecular Physics · 2015 · 85 citations

Engineering, Geometry Generation, Computer-aided Design +23

Explicitly correlated MRCI-F12 potential energy surfaces for methane fit with several permutation invariant schemes and full-dimensional vibrational calculations

Moumita Majumder, Samuel E. Hegger, Richard Dawes et al. · Molecular Physics · 2015 · 72 citations

Engineering, Neural Network, Computational Chemistry +19

CH⋯π and π⋯π interaction in benzene–acetylene clusters

Moumita Majumder, Brijesh Kumar Mishra, N. Sathyamurthy · Chemical Physics Letters · 2012 · 38 citations

Cluster Science, π⋯π Interaction, Physical Chemistry +3

Chemical Dynamics Simulations and Scattering Experiments for O₂ Collisions with Graphite

Moumita Majumder, K. D. Gibson, S. J. Sibener et al. · The Journal of Physical Chemistry C · 2018 · 24 citations

Engineering, Residence Time, Material Simulation +23

A theoretical investigation on the effect of π–π stacking interaction on 1H isotropic chemical shielding in certain homo- and hetero-nuclear aromatic systems

Moumita Majumder, N. Sathyamurthy · Theoretical Chemistry Accounts · 2012 · 23 citations

Hetero-nuclear Aromatic Systems, Theoretical Investigation, Natural Sciences +7