James W Furness

10PUBLICATIONS
35CO-AUTHORS
Chemical thermodynamics and energeticsTheoretical quantum chemistryProgramming languagesElectronic and magnetic properties of condensed matter; superconductivityRadiation and matter
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Publications (10)

|Mar 04, 2026
Toward Chemical Accuracy for Chemi- and Physisorption with an Efficient Density Functional.

Manish Kothakonda, Abhirup Patra, Ruiqi Zhang

|Sep 23, 2024
Ab Initio Calculation of Coupling-Constant Averaged Exchange-Correlation Holes for Spherically Symmetric Atoms.

Lin Hou, Tom J P Irons, Yanyong Wang

|Aug 02, 2024
Quantum chemical package Jaguar: A survey of recent developments and unique features.

Yixiang Cao, Ty Balduf, Michael D Beachy

|Jan 05, 2024
Capturing the electron-electron cusp with the coupling-constant averaged exchange-correlation hole: A case study for Hooke's atoms.

Lin Hou, Tom J P Irons, Yanyong Wang

|Dec 13, 2023
Testing the r2SCAN Density Functional for the Thermodynamic Stability of Solids with and without a van der Waals Correction.

Manish Kothakonda, Aaron D Kaplan, Eric B Isaacs

|Aug 15, 2023
Comparative Density Functional Theory Study of Magnetic Exchange Couplings in Dinuclear Transition-Metal Complexes.

Henry C Fitzhugh, James W Furness, Mark R Pederson

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Frequent Collaborators

8 joint publications

Jianwei Sun

4 joint publications

Tom J P Irons

4 joint publications

Andrew M Wibowo-Teale

3 joint publications

Aaron D Kaplan