Abhilash Patra

6PUBLICATIONS
13CO-AUTHORS
Mathematical aspects of general relativityComputational chemistryTheoretical quantum chemistry
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Publications (6)

|Sep 16, 2021
Bandgap of two-dimensional materials: Thorough assessment of modern exchange-correlation functionals.

Fabien Tran, Jan Doumont, Leila Kalantari

|Dec 09, 2020
Insights from the density functional performance of water and water-solid interactions: SCAN in relation to other meta-GGAs.

Subrata Jana, Abhilash Patra, Szymon Śmiga

|Nov 14, 2020
A way of resolving the order-of-limit problem of Tao-Mo semilocal functional.

Abhilash Patra, Subrata Jana, Prasanjit Samal

|Sep 03, 2020
Efficient yet accurate dispersion-corrected semilocal exchange-correlation functionals for non-covalent interactions.

Abhilash Patra, Subrata Jana, Lucian A Constantin

|Apr 24, 2020
Improved transition metal surface energies from a generalized gradient approximation developed for quasi two-dimensional systems.

Abhilash Patra, Subrata Jana, Lucian A Constantin

|Feb 03, 2020
Screened range-separated hybrid by balancing the compact and slowly varying density regimes: Satisfaction of local density linear response.

Subrata Jana, Abhilash Patra, Lucian A Constantin

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