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cond-mat.mtrl-sci2026
Thermal PBE in warm dense matter: Does it matter and is it accurate?
Kushal Ramakrishna, Mani Lokamani, Zhandos A. Moldabekov +3
Conditional probability density functional theory has recently been used to derive the temperature dependence of the Perdew-Burke-Ernzerhof (PBE) generalized gradient approximation…
cond-mat.mtrl-sci2026
Conditional probability density functional theory for solids
Peiwei You, Ryan Pederson, Kieron Burke +1
The recently developed conditional probability density functional theory (CP-DFT) yields direct access to the exchange-correlation hole of a system, an important correlation functi…