Aurora Pribram-Jones

发表

Adiabatic release measurements in aluminum between 400 and 1200 GPa: Characterization of aluminum as a shock standard in the multimegabar regime

M. Desjarlais, M. Knudson, Aurora Pribram-Jones, 2015 .

Thermal Density Functional Theory in Context

Kieron Burke, Aurora Pribram-Jones, Stefano Pittalis, 2013, 1309.3043.

Comparison of Linear Response Theory, Projected Initial Maximum Overlap Method, and Molecular Dynamics-Based Vibronic Spectra: The Case of Methylene Blue.

C. Isborn, H. Hratchian, T. Zuehlsdorff, 2022, Journal of chemical theory and computation.

Supplemental material for “Direct extraction of excitation energies from ensemble density-functional theory”

K. Burke, C. Ullrich, Zeng-Hui Yang, 2017 .

Comparing correlation components and approximations in Hartree-Fock and Kohn-Sham theories via an analytical test case study.

Aurora Pribram-Jones, S. Giarrusso, 2022, The Journal of chemical physics.

Predicting ductility in quaternary B2 -like alloys

Patrick Conway, Aurora Pribram-Jones, L. Bassman, 2021, Physical Review Materials.

Thermal Density Functional Theory: Time-Dependent Linear Response and Approximate Functionals from the Fluctuation-Dissipation Theorem.

Kieron Burke, Aurora Pribram-Jones, K. Burke, 2015, Physical review letters.

Exact thermal density functional theory for a model system: Correlation components and accuracy of the zero-temperature exchange-correlation approximation

Kieron Burke, Aurora Pribram-Jones, K. Burke, 2015, 1509.03097.

Thermal Corrections to Density Functional Simulations of Warm Dense Matter

Kieron Burke, Aurora Pribram-Jones, K. Burke, 2015 .

Exact conditions on the temperature dependence of density functionals

Kieron Burke, Aurora Pribram-Jones, Paul E. Grabowski, 2015, 1511.02194.

DFT: A Theory Full of Holes?

Kieron Burke, Aurora Pribram-Jones, K. Burke, 2014, Annual review of physical chemistry.

A ug 2 01 4 DFT : A Theory Full of Holes ?

K. Burke, Aurora Pribram-Jones, D. Gross, 2014 .

Using projection operators with maximum overlap methods to simplify challenging self‐consistent field optimization

H. Hratchian, Aurora Pribram-Jones, H. Corzo, 2021, J. Comput. Chem..

Direct Extraction of Excitation Energies from Ensemble Density-Functional Theory.

K. Burke, C. Ullrich, Zeng-Hui Yang, 2017, Physical review letters.

Approximate bounds and temperature dependence of adiabatic connection integrands for the uniform electron gas.

Aurora Pribram-Jones, Brittany P. Harding, Zachary Mauri, 2021, The Journal of chemical physics.

Connection formulas for thermal density functional theory

Kieron Burke, Aurora Pribram-Jones, K. Burke, 2015, 1509.03060.

Excitations and benchmark ensemble density functional theory for two electrons.

Kieron Burke, Aurora Pribram-Jones, Richard J. Needs, 2014, The Journal of chemical physics.

Comparison of Linear Response Theory, Projected Initial Maximum Overlap Method, and Molecular Dynamics-Based Vibronic Spectra: The Case of Methylene Blue.

C. Isborn, H. Hratchian, T. Zuehlsdorff, 2021, Journal of chemical theory and computation.

Exact Conditions for Ensemble Density Functional Theory

K. Burke, Aurora Pribram-Jones, Steven Crisostomo, 2023, 2307.00187.

Assessing Mg–Sc–(rare earth) ternary phase stability via constituent binary cluster expansions

M. Ferry, Aurora Pribram-Jones, L. Bassman, 2022, Computational Materials Science.