Tom Ziegler, Ph.D.

1986-2015 Chemistry University of Calgary, Calgary, Alberta, Canada 
density functional theory, catalysis, ab initio molecular dynamics, electronic structure theory
"Tom Ziegler"
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Park YC, Senn F, Krykunov M, et al. (2016) Self-Consistent Constricted Variational Theory RSCF-CV(∞)-DFT and its Restrictions to Obtain a Numerically Stable ΔSCF-DFT-like Method: Theory and Calculations for Triplet States. Journal of Chemical Theory and Computation
Han JE, Jones JL, Tangpricha V, et al. (2016) High Dose Vitamin D Administration in Ventilated Intensive Care Unit Patients: A Pilot Double Blind Randomized Control Trial. Journal of Clinical & Translational Endocrinology. 4: 59-65
Seidu I, Krykunov M, Ziegler T. (2015) Applications of Time-Dependent and Time-Independent Density Functional Theory to Electronic Transitions in Tetrahedral d(0) Metal Oxides. Journal of Chemical Theory and Computation. 11: 4041-4053
Casaer MP, Ziegler TR. (2015) Nutritional support in critical illness and recovery. The Lancet. Diabetes & Endocrinology
Ziegler T, Krykunov M, Seidu I, et al. (2015) Constricted Variational Density Functional Theory Approach to the Description of Excited States. Topics in Current Chemistry
Seidu I, Krykunov M, Ziegler T. (2015) Applications of time-dependent and time-independent density functional theory to Rydberg transitions. The Journal of Physical Chemistry. A. 119: 5107-16
Park YC, Krykunov M, Ziegler T. (2015) On the relation between adiabatic time dependent density functional theory (TDDFT) and the ΔsCF-DFT method. Introducing a numerically stable ΔsCF-DFT scheme for local functionals based on constricted variational DFT Molecular Physics. 113: 1636-1647
Ziegler T, Krykunov M, Autschbach J. (2014) Derivation of the RPA (Random Phase Approximation) Equation of ATDDFT (Adiabatic Time Dependent Density Functional Ground State Response Theory) from an Excited State Variational Approach Based on the Ground State Functional. Journal of Chemical Theory and Computation. 10: 3980-6
Zhekova H, Krykunov M, Autschbach J, et al. (2014) Applications of Time Dependent and Time Independent Density Functional Theory to the First π to π* Transition in Cyanine Dyes. Journal of Chemical Theory and Computation. 10: 3299-307
Han JE, Ziegler TR. (2014) Vitamin D supplementation in sepsis and critical illness: where are we now? American Journal of Respiratory and Critical Care Medicine. 190: 483-5
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