Alex P. Gaiduk
Affiliations: | 2008-2013 | University of Western Ontario, London, Ontario, Canada | |
| 2014-2018 | Molecular Engineering | University of Chicago, Chicago, IL |
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Parents
Sign in to add mentor| Viktor N. Staroverov | grad student | 2008-2013 | Western University |
| Giulia Galli | post-doc | 2013-2018 | Chicago |
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Publications
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| Gaiduk AP, Gustafson JA, Gygi F, et al. (2018) First-Principles Simulations of Liquid Water Using a Dielectric-Dependent Hybrid Functional. The Journal of Physical Chemistry Letters |
| Gaiduk AP, Pham TA, Govoni M, et al. (2018) Electron affinity of liquid water. Nature Communications. 9: 247 |
| Gaiduk AP, Galli G. (2017) Local and Global Effects of Dissolved Sodium Chloride on the Structure of Water. The Journal of Physical Chemistry Letters |
| Gaiduk AP, Govoni M, Seidel R, et al. (2016) Photoelectron spectra of aqueous solutions from first principles. Journal of the American Chemical Society |
| Gaiduk AP, Gygi F, Galli G. (2015) Density and Compressibility of Liquid Water and Ice from First-Principles Simulations with Hybrid Functionals. The Journal of Physical Chemistry Letters. 6: 2902-8 |
| Gaiduk AP, Zhang C, Gygi F, et al. (2014) Structural and electronic properties of aqueous NaCl solutions from ab initio molecular dynamics simulations with hybrid density functionals Chemical Physics Letters. 604: 89-96 |
| Gaiduk AP, Ryabinkin IG, Staroverov VN. (2013) Removal of Basis-Set Artifacts in Kohn-Sham Potentials Recovered from Electron Densities. Journal of Chemical Theory and Computation. 9: 3959-64 |
| Kananenka AA, Kohut SV, Gaiduk AP, et al. (2013) Efficient construction of exchange and correlation potentials by inverting the Kohn-Sham equations. The Journal of Chemical Physics. 139: 074112 |
| Gaiduk AP, Firaha DS, Staroverov VN. (2012) Improved electronic excitation energies from shape-corrected semilocal Kohn-Sham potentials. Physical Review Letters. 108: 253005 |
| Gaiduk AP, Staroverov VN. (2012) A generalized gradient approximation for exchange derived from the model potential of van Leeuwen and Baerends. The Journal of Chemical Physics. 136: 064116 |