Elena Jakubı́ková

Calculation of One-Electron Redox Potentials Revisited. Is It Possible to Calculate Accurate Potentials with Density Functional Methods?

Lindsay E. Roy, Elena Jakubı́ková, M. Guthrie et al. · The Journal of Physical Chemistry A · 2009 · 320 citations

Natural Sciences, Chemistry, Computational Chemistry +16

Low-Spin versus High-Spin Ground State in Pseudo-Octahedral Iron Complexes

David N. Bowman, Elena Jakubı́ková · Inorganic Chemistry · 2012 · 146 citations

Natural Sciences, Chemistry, Physics +17

Ironing out the photochemical and spin-crossover behavior of Fe(II) coordination compounds with computational chemistry

Daniel C. Ashley, Elena Jakubı́ková · Coordination Chemistry Reviews · 2017 · 120 citations

Natural Sciences, Chemistry, Physics +14

Electronic Structure and Spectroscopy of [Ru(tpy)₂]²⁺, [Ru(tpy)(bpy)(H₂O)]²⁺, and [Ru(tpy)(bpy)(Cl)]⁺

Elena Jakubı́ková, Weizhong Chen, Dana M. Dattelbaum et al. · Inorganic Chemistry · 2009 · 111 citations

Natural Sciences, Chemistry, Physics +15

A flexible, redox-active macrocycle enables the electrocatalytic reduction of nitrate to ammonia by a cobalt complex

Song Xu, Daniel C. Ashley, Hyuk‐Yong Kwon et al. · Chemical Science · 2018 · 94 citations · Full text

Natural Sciences, Chemical Engineering, Chemistry +14