Pragya Verma

14PUBLICATIONS
35CO-AUTHORS
HydrometallurgyTheoretical quantum chemistryAtomic, molecular and optical physics not elsewhere classifiedAtomic and molecular physicsTransition metal chemistry
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Publications (14)

|Apr 03, 2025
Formation of hydrided Pt-Ce-H sites in efficient, selective oxidation catalysts.

Ji Yang, Lorenz J Falling, Siyang Yan

|Dec 14, 2023
M11pz: A Nonlocal Meta Functional with Zero Hartree-Fock Exchange and with Broad Accuracy for Chemical Energies and Structures.

Siriluk Kanchanakungwankul, Pragya Verma, Benjamin G Janesko

|Nov 08, 2023
Comparing Density Functional Theory Metal-Ligand Bond Dissociation Enthalpies with Experimental Solution-Phase Enthalpies of Activation for Bond Dissociation.

Edward N Brothers, Ashfaq A Bengali, Giovanni Scalmani

|Dec 15, 2022
Performance of Screened-Exchange Functionals for Band Gaps and Lattice Constants of Crystals.

Cheng Zhang, Pragya Verma, Jiaxu Wang

|Mar 27, 2020
M11plus, a Range-Separated Hybrid Meta Functional Incorporating Nonlocal Rung-3.5 Correlation, Exhibits Broad Accuracy on Diverse Databases.

Benjamin G Janesko, Pragya Verma, Giovanni Scalmani

|Jan 19, 2020
M06-SX screened-exchange density functional for chemistry and solid-state physics.

Ying Wang, Pragya Verma, Lujia Zhang

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Frequent Collaborators

13 joint publications

Donald G Truhlar

4 joint publications

Ying Wang

4 joint publications

Xiao He

4 joint publications

Benjamin G Janesko