| 1 |
Identification of Structural Calcium Binding Sites in Membrane-Bound Presenilin 1 and 2
Mehra R, Kepp KP
Journal of Physical Chemistry B, 124(23), 4697, 2020 |
| 2 |
The Metal Hydride Problem of Computational Chemistry: Origins and Consequences
Moltved KA, Kepp KP
Journal of Physical Chemistry A, 123(13), 2888, 2019 |
| 3 |
Free Energies of Hydration for Metal Ions from Heats of Vaporization
Kepp KP
Journal of Physical Chemistry A, 123(30), 6536, 2019 |
| 4 |
Electron Transfer of Hydrated Transition-Metal Ions and the Electronic State of Co3+(aq)
Nielsen MT, Moltved KA, Kepp KP
Inorganic Chemistry, 57(13), 7914, 2018 |
| 5 |
Iron(II) and Iron(III) Spin Crossover: Toward an Optimal Density Functional
Siig OS, Kepp KP
Journal of Physical Chemistry A, 122(16), 4208, 2018 |
| 6 |
Thermochemically Consistent Free Energies of Hydration for Di- and Trivalent Metal Ions
Kepp KP
Journal of Physical Chemistry A, 122(37), 7464, 2018 |
| 7 |
Redox Potentials and Electronic States of Iron Porphyrin IX Adsorbed on Single Crystal Gold Electrode Surfaces
Zhang L, Kepp KP, Ulstrup J, Zhang JD
Langmuir, 34(12), 3610, 2018 |
| 8 |
Benchmarking Density Functionals for Chemical Bonds of Gold
Kepp KP
Journal of Physical Chemistry A, 121(9), 2022, 2017 |
| 9 |
Trends in Strong Chemical Bonding in C-2, CN, CN-, CO, N-2, NO, NO+, and O-2
Kepp KP
Journal of Physical Chemistry A, 121(47), 9092, 2017 |
| 10 |
Comment on "Density functional theory is straying from the path toward the exact functional"
Kepp KP
Science, 356(6337), 2017 |
