Publications by authors named "JP Perdew"

Claim this Profile
Î
ΔSCF Excitation Energies up a Ladder of Ground-State Density Functionals.
Ethan Pollack, Rohan Maniar, John P Perdew

J Phys Chem A· November 2025

Social Media Activity not collected for this article yet.

Sign Up to Request Social Media Analysis
C
Comment on "Accurate Correlation Potentials from the Self-Consistent Random Phase Approximation".
Chandra Shahi, John P Perdew

Phys Rev Lett· July 2025

Social Media Activity not collected for this article yet.

Sign Up to Request Social Media Analysis
T
The electron localization function and the chemical interpretation of Fermi orbital descriptors in Fermi-Löwdin self-interaction correction calculations.
Duyen B Nguyen, Carlos Cárdenas, Jerónimo Lira, John P Perdew, Koblar A Jackson

J Chem Phys· April 2025

Social Media Activity not collected for this article yet.

Sign Up to Request Social Media Analysis
A
Atomic ionization: sd energy imbalance and Perdew-Zunger self-interaction correction energy penalty in 3d atoms.
Rohan Maniar, Priyanka B Shukla, J Karl Johnson, Koblar A Jackson, John P Perdew

Proc Natl Acad Sci U S A· March 2025

Social Media Activity not collected for this article yet.

Sign Up to Request Social Media Analysis
V
Vertical Ionization Energies, Generalized Kohn-Sham Orbital Energies, and the Curious Case of the Copper Oxide Anions.
Chandra Shahi, Rohan Maniar, Jinliang Ning, Gábor I Csonka, John P Perdew

J Phys Chem A· October 2024

Social Media Activity not collected for this article yet.

Sign Up to Request Social Media Analysis
H
How Does HF-DFT Achieve Chemical Accuracy for Water Clusters?
Aaron D Kaplan, Chandra Shahi, Raj K Sah, Pradeep Bhetwal, Bikash Kanungo, John P Perdew

J Chem Theory Comput· July 2024

Social Media Activity not collected for this article yet.

Sign Up to Request Social Media Analysis
C
Challenges for density functional theory in simulating metal-metal singlet bonding: A case study of dimerized VO2.
Yubo Zhang, Da Ke, Junxiong Wu, Chutong Zhang, Lin Hou, John P Perdew

J Chem Phys· April 2024

Social Media Activity not collected for this article yet.

Sign Up to Request Social Media Analysis
S
Symmetry breaking and self-interaction correction in the chromium atom and dimer.
Rohan Maniar, Kushantha P K Withanage, Chandra Shahi, Aaron D Kaplan, John P Perdew

J Chem Phys· April 2024

Social Media Activity not collected for this article yet.

Sign Up to Request Social Media Analysis
C
Comparing first-principles density functionals plus corrections for the lattice dynamics of YBa2Cu3O6.
Jinliang Ning, Christopher Lane, Bernardo Barbiellini, Robert S Markiewicz, Arun Bansil, John P Perdew

J Chem Phys· February 2024

Social Media Activity not collected for this article yet.

Sign Up to Request Social Media Analysis
U
Unconventional Error Cancellation Explains the Success of Hartree-Fock Density Functional Theory for Barrier Heights.
Bikash Kanungo, Aaron D Kaplan, Chandra Shahi, Vikram Gavini, John P Perdew

J Phys Chem Lett· January 2024

Social Media Activity not collected for this article yet.

Sign Up to Request Social Media Analysis
M
My life in science: Lessons for yours?
John P Perdew

J Chem Phys· January 2024

Social Media Activity not collected for this article yet.

Sign Up to Request Social Media Analysis
T
The Predictive Power of Exact Constraints and Appropriate Norms in Density Functional Theory.
Aaron D Kaplan, Mel Levy, John P Perdew

Annu Rev Phys Chem· April 2023

Social Media Activity not collected for this article yet.

Sign Up to Request Social Media Analysis
T
Testing the rSCAN Density Functional for the Thermodynamic Stability of Solids with and without a van der Waals Correction.
Manish Kothakonda, Aaron D Kaplan, Eric B Isaacs, Christopher J Bartel, James W Furness, John P Perdew

ACS Mater Au· March 2023

Social Media Activity not collected for this article yet.

Sign Up to Request Social Media Analysis
S
Symmetry Breaking with the SCAN Density Functional Describes Strong Correlation in the Singlet Carbon Dimer.
John P Perdew, Shah Tanvir Ur Rahman Chowdhury, Chandra Shahi, Aaron D Kaplan, Duo Song

J Phys Chem A· January 2023

Social Media Activity not collected for this article yet.

Sign Up to Request Social Media Analysis
U
Understanding Density-Driven Errors for Reaction Barrier Heights.
Aaron D Kaplan, Chandra Shahi, Pradeep Bhetwal, Raj K Sah, John P Perdew

J Chem Theory Comput· January 2023

Social Media Activity not collected for this article yet.

Sign Up to Request Social Media Analysis
D
DFT exchange: sharing perspectives on the workhorse of quantum chemistry and materials science.
Andrew M Teale, Trygve Helgaker, Andreas Savin, Carlo Adamo, Bálint Aradi, John P Perdew

Phys Chem Chem Phys· December 2022

Social Media Activity not collected for this article yet.

Sign Up to Request Social Media Analysis
H
How Good Is the Density-Corrected SCAN Functional for Neutral and Ionic Aqueous Systems, and What Is So Right about the Hartree-Fock Density?
Saswata Dasgupta, Chandra Shahi, Pradeep Bhetwal, John P Perdew, Francesco Paesani

J Chem Theory Comput· August 2022

Social Media Activity not collected for this article yet.

Sign Up to Request Social Media Analysis
F
Fermi-Löwdin orbital self-interaction correction of adsorption energies on transition metal ions.
Kushantha P K Withanage, Kamal Sharkas, J Karl Johnson, John P Perdew, Juan E Peralta

J Chem Phys· April 2022

Social Media Activity not collected for this article yet.

Sign Up to Request Social Media Analysis
C
Construction of meta-GGA functionals through restoration of exact constraint adherence to regularized SCAN functionals.
James W Furness, Aaron D Kaplan, Jinliang Ning, John P Perdew, Jianwei Sun

J Chem Phys· January 2022

Social Media Activity not collected for this article yet.

Sign Up to Request Social Media Analysis
A
Artificial intelligence "sees" split electrons.
John P Perdew

Science· December 2021

Social Media Activity not collected for this article yet.

Sign Up to Request Social Media Analysis
S
Spherical vs non-spherical and symmetry-preserving vs symmetry-breaking densities of open-shell atoms in density functional theory.
Shah Tanvir Ur Rahman Chowdhury, John P Perdew

J Chem Phys· December 2021

Social Media Activity not collected for this article yet.

Sign Up to Request Social Media Analysis
E
Elevating density functional theory to chemical accuracy for water simulations through a density-corrected many-body formalism.
Saswata Dasgupta, Eleftherios Lambros, John P Perdew, Francesco Paesani

Nat Commun· November 2021

Social Media Activity not collected for this article yet.

Sign Up to Request Social Media Analysis
M
Modeling Liquid Water by Climbing up Jacob's Ladder in Density Functional Theory Facilitated by Using Deep Neural Network Potentials.
Chunyi Zhang, Fujie Tang, Mohan Chen, Jianhang Xu, Linfeng Zhang, John P Perdew

J Phys Chem B· October 2021

Social Media Activity not collected for this article yet.

Sign Up to Request Social Media Analysis
S
Self-interaction correction in water-ion clusters.
Kamal Wagle, Biswajit Santra, Puskar Bhattarai, Chandra Shahi, Mark R Pederson, John P Perdew

J Chem Phys· March 2021

Social Media Activity not collected for this article yet.

Sign Up to Request Social Media Analysis
E
Exploring and enhancing the accuracy of interior-scaled Perdew-Zunger self-interaction correction.
Puskar Bhattarai, Biswajit Santra, Kamal Wagle, Yoh Yamamoto, Rajendra R Zope, John P Perdew

J Chem Phys· March 2021

Social Media Activity not collected for this article yet.

Sign Up to Request Social Media Analysis