The biologically relevant coordination chemistry of iron and nitric oxide: electronic structure and reactivity
Nitric oxide (NO) is an important signaling molecule that is involved in a wide range of
physiological and pathological events in biology. Metal coordination chemistry, especially …
physiological and pathological events in biology. Metal coordination chemistry, especially …
Surface chemistry of porphyrins and phthalocyanines
JM Gottfried - Surface Science Reports, 2015 - Elsevier
This review covers the surface chemistry of porphyrins, phthalocyanines, their metal
complexes, and related compounds, with particular focus on chemical reactions at …
complexes, and related compounds, with particular focus on chemical reactions at …
Reversing nitrogen fixation
The nitrogen cycle is one of the most important biogeochemical cycles on Earth because
nitrogen is an essential nutrient for all life forms. To supplement natural nitrogen fixation …
nitrogen is an essential nutrient for all life forms. To supplement natural nitrogen fixation …
Photocatalytically Active Superstructures of Quantum Dots and Iron Porphyrins for Reduction of CO2 to CO in Water
This paper describes the use of electrostatic assemblies of negatively charged colloidal
CuInS2/ZnS quantum dot (QD) sensitizers and positively charged, trimethylamino …
CuInS2/ZnS quantum dot (QD) sensitizers and positively charged, trimethylamino …
Powering a CO2 Reduction Catalyst with Visible Light through Multiple Sub-picosecond Electron Transfers from a Quantum Dot
Photosensitization of molecular catalysts to reduce CO2 to CO is a sustainable route to
storable solar fuels. Crucial to the sensitization process is highly efficient transfer of redox …
storable solar fuels. Crucial to the sensitization process is highly efficient transfer of redox …
Selective Electrocatalytic Reduction of NO to NH3 by Iron Porphyrins at Physiologically Relevant Potentials
Nitric oxide (NO), a toxic gas, is a key intermediate in the global nitrogen cycle that may be
reduced to produce NH3. However, there are few molecular catalysts which can catalyze …
reduced to produce NH3. However, there are few molecular catalysts which can catalyze …
Advanced aspects of ab initio theoretical optical spectroscopy of transition metal complexes: Multiplets, spin-orbit coupling and resonance Raman intensities
F Neese, T Petrenko, D Ganyushin, G Olbrich - Coordination Chemistry …, 2007 - Elsevier
In this review some advanced aspects of the theoretical methods for the calculation of
transition metal optical spectra with ab initio methods are discussed. Density functional …
transition metal optical spectra with ab initio methods are discussed. Density functional …
Binding of CO, NO, and O2 to Heme by Density Functional and Multireference ab Initio Calculations
M Radon, K Pierloot - The Journal of Physical Chemistry A, 2008 - ACS Publications
Using the CASSCF/CASPT2 approach, along with several DFT methods (PBE0, B3LYP,
BP86, OLYP), we have investigated the bonding of CO, NO, and O2 molecules to two model …
BP86, OLYP), we have investigated the bonding of CO, NO, and O2 molecules to two model …
Mono-and dinuclear non-heme iron–nitrosyl complexes: Models for key intermediates in bacterial nitric oxide reductases
TC Berto, AL Speelman, S Zheng, N Lehnert - Coordination Chemistry …, 2013 - Elsevier
High-spin non-heme iron–nitrosyls are of direct interest to both the chemical and biological
communities as these species exhibit interesting chemical properties and act as direct …
communities as these species exhibit interesting chemical properties and act as direct …
Electronic structure of heme-nitrosyls and its significance for nitric oxide reactivity, sensing, transport, and toxicity in biological systems
LE Goodrich, F Paulat, VKK Praneeth… - Inorganic …, 2010 - ACS Publications
This review summarizes recent developments in the investigation of the electronic
structures, spectroscopic properties, and reactivities of ferrous and ferric heme-nitrosyls and …
structures, spectroscopic properties, and reactivities of ferrous and ferric heme-nitrosyls and …