Univ. Florida Technical Notes (unpublished; copyrighted)
2023 Technical Notes
Basics of the flexible density
H. Francisco, A.C. Cancio, and S.B. Trickey [22 June 2023]
Abstract
This UF Technical Note has no abstract.
2014 Technical Notes
Rudiments of Exact Exchange in DFT
S.B. Trickey [05 May 2014]
Abstract
This UF Technical Note has no abstract.
2013 Technical Notes
Relationships Among Various Forms of Fermi-Dirac Integrals of Low Order
S.B. Trickey [04 March 2013]
Abstract
Different integral forms all are called Fermi-Dirac integrals. The relationship between two such forms is worked out here.
2012 Technical Notes
Comparison of path integral Monte Carlo, coupled electron-ion Monte Carlo, and Kohn-Sham simulations for Hydrogen and Deuterium
V.V. Karasiev [18 Oct. 2012]
Abstract
This UF Technical Note has no abstract.
2011 Technical Notes
Local-Scaling Transformation version of Density Functional Theory
V.V. Karasiev [16 Dec. 2011]
Abstract
This UF Technical Note has no abstract.
2010 Technical Notes
Details of Equations in Perrot, Phys. Rev. A 20, 586 (1979)
Travis Sjostrom and S.B. Trickey [13 Aug. 2010]
Abstract
Clarification and correction are given of Perrot’s 1979 development of the free energy of the weakly inhomogeneous electron gas. Related corrections in Fromy et al. (1996) are given, along with connections to Furutani et al. (1986).
Nuclear Site Singularity in the Functional Derivative of the von Weizsäcker KE
S.B. Trickey [27 Nov. 2010]
Abstract
The functional derivative of the von Weizsäcker KE has a singularity at the nuclear site for an atomic density consistent with the Kato cusp condition.
Su-Goddard Electron Force Field and Car-Parrinello Dynamics
S.B. Trickey [29 June 2010]
Abstract
This UF Technical Note has no abstract.
2007 Technical Notes
vθGGA, the Functional Derivative of a GGA Pauli Term Tθ
S.B. Trickey [26 Nov. 2007]
Abstract
This UF Technical Note has no abstract.