Chandan Kumar

Relation Between Ring Currents and Hydrogenation Enthalpies for Assessing the Degree of Aromaticity

Chandan Kumar, Heike Fliegl, Dage Sundholm · The Journal of Physical Chemistry A · 2017 · 44 citations · Full text

Natural Sciences, Chemistry, Physics +17

Accelerating Kohn‐Sham response theory using density fitting and the auxiliary‐density‐matrix method

Chandan Kumar, Heike Fliegl, Frank Jensen et al. · International Journal of Quantum Chemistry · 2018 · 23 citations · Full text

Natural Sciences, Chemistry, Physics +14

Implementation of Nuclear Velocity Perturbation and Magnetic Field Perturbation Theory in CP2K and Their Application to Vibrational Circular Dichroism

Edward Ditler, Tomáš Zimmermann, Chandan Kumar et al. · Journal of Chemical Theory and Computation · 2022 · 21 citations

Natural Sciences, Chemistry, Physics +16

Classical and quantum trial wave functions in auxiliary-field quantum Monte Carlo applied to oxygen allotropes and a CuBr2 model system

Maximilian Amsler, Peter Deglmann, Matthias Degroote et al. · The Journal of Chemical Physics · 2023 · 14 citations

Natural Sciences, Chemistry, Materials Science +17

Analytic calculation and analysis of atomic polar tensors for molecules and materials using the Gaussian and plane waves approach

Edward Ditler, Chandan Kumar, Sandra Luber · The Journal of Chemical Physics · 2021 · 12 citations

Natural Sciences, Chemistry, Physics +17