scholarly article | Q13442814 |
P50 | author | Frederico Alves Lima | Q54780184 |
Serena DeBeer | Q65944872 | ||
Ragnar Bjornsson | Q38318164 | ||
Joanna Kowalska | Q41191099 | ||
P2093 | author name string | Franc Meyer | |
Antonia Albers | |||
Christine E Schiewer | |||
Anselm W Hahn | |||
P2860 | cites work | Density-functional exchange-energy approximation with correct asymptotic behavior | Q21709057 |
Mechanism of nitrogen fixation by nitrogenase: the next stage | Q26828626 | ||
Density-functional approximation for the correlation energy of the inhomogeneous electron gas | Q27440259 | ||
A cluster exposed: structure of the Rieske ferredoxin from biphenyl dioxygenase and the redox properties of Rieske Fe-S proteins | Q27629759 | ||
Structure, function, and formation of biological iron-sulfur clusters | Q29619664 | ||
Biosynthesis of nitrogenase metalloclusters | Q30405689 | ||
Iron-sulfur clusters: nature's modular, multipurpose structures | Q30427883 | ||
ATHENA, ARTEMIS, HEPHAESTUS: data analysis for X-ray absorption spectroscopy using IFEFFIT. | Q30992493 | ||
A seven-crystal Johann-type hard x-ray spectrometer at the Stanford Synchrotron Radiation Lightsource | Q33458260 | ||
Mechanism of Mo-dependent nitrogenase | Q33622954 | ||
Sensitivity of X-ray core spectroscopy to changes in metal ligation: a systematic study of low-coordinate, high-spin ferrous complexes. | Q33646054 | ||
Rubredoxin: a new electron transfer protein from Clostridium pasteurianum | Q33804728 | ||
Re-evaluating the Cu K pre-edge XAS transition in complexes with covalent metal-ligand interactions | Q49274156 | ||
An overlap fitted chain of spheres exchange method. | Q51515134 | ||
Effect of the damping function in dispersion corrected density functional theory. | Q51596718 | ||
Balanced basis sets of split valence, triple zeta valence and quadruple zeta valence quality for H to Rn: Design and assessment of accuracy. | Q51961792 | ||
Biomimetic [2Fe-2S] clusters with extensively delocalized mixed-valence iron centers. | Q52862263 | ||
Iron-sulfur clusters: ever-expanding roles. | Q54468603 | ||
Structural Basis of Biological Nitrogen Fixation. | Q55035691 | ||
Transformation of a Mononitrosyl Iron Complex to a [2Fe-2S] Cluster by a Cysteine Analogue | Q56971551 | ||
Calibration of Scalar Relativistic Density Functional Theory for the Calculation of Sulfur K-Edge X-ray Absorption Spectra | Q58009881 | ||
All-Electron Scalar Relativistic Basis Sets for Third-Row Transition Metal Atoms | Q58010047 | ||
Importance of Direct Spin−Spin Coupling and Spin-Flip Excitations for the Zero-Field Splittings of Transition Metal Complexes: A Case Study | Q58010158 | ||
Probing the 3d spin momentum with X-ray emission spectroscopy: the case of molecular-spin transitions | Q79789668 | ||
The LNLS soft X-ray spectroscopy beamline | Q80359267 | ||
X-ray filter assembly for fluorescence measurements of x-ray absorption fine structure | Q81776950 | ||
X-ray absorption spectroscopy | Q84744867 | ||
The complete characterization of a reduced biomimetic [2Fe-2S] cluster | Q84946203 | ||
Iron-amide-sulfide and iron-imide-sulfide clusters: heteroligated core environments relevant to the nitrogenase FeMo cofactor | Q85423309 | ||
Insights into properties and energetics of iron-sulfur proteins from simple clusters to nitrogenase | Q33844088 | ||
Kβ mainline X-ray emission spectroscopy as an experimental probe of metal-ligand covalency | Q33879221 | ||
Nitrogenase: standing at the crossroads | Q34046387 | ||
Characterization of isolated nitrogenase FeVco | Q34131445 | ||
Structural insights into a protein-bound iron-molybdenum cofactor precursor | Q34334877 | ||
Comparative assessment of the composition and charge state of nitrogenase FeMo-cofactor | Q35017261 | ||
Detailed Characterization of a Nanosecond-Lived Excited State: X-ray and Theoretical Investigation of the Quintet State in Photoexcited [Fe(terpy)2](2.) | Q35201688 | ||
Probing Cu(I) in homogeneous catalysis using high-energy-resolution fluorescence-detected X-ray absorption spectroscopy | Q35637143 | ||
Protonation and concerted proton-electron transfer reactivity of a bis-benzimidazolate ligated [2Fe-2S] model for Rieske clusters | Q35928432 | ||
X-ray emission spectroscopy to study ligand valence orbitals in Mn coordination complexes | Q37364290 | ||
Developments in the biomimetic chemistry of cubane-type and higher nuclearity iron-sulfur clusters | Q37696184 | ||
Parameter-free calculations of X-ray spectra with FEFF9. | Q37743237 | ||
Fe-S proteins that regulate gene expression | Q38275779 | ||
The role of X-ray spectroscopy in understanding the geometric and electronic structure of nitrogenase. | Q38285173 | ||
The discovery of Mo(III) in FeMoco: reuniting enzyme and model chemistry | Q38303983 | ||
Insights into the geometric and electronic structure of transition metal centers from valence-to-core X-ray emission spectroscopy | Q38960669 | ||
Nitrogenase FeMoco investigated by spatially resolved anomalous dispersion refinement | Q39024061 | ||
Manganese Kβ X-ray emission spectroscopy as a probe of metal-ligand interactions | Q39722478 | ||
Probing valence orbital composition with iron Kbeta X-ray emission spectroscopy | Q39860207 | ||
Prediction of high-valent iron K-edge absorption spectra by time-dependent density functional theory | Q39907147 | ||
In search of metal hydrides: an X-ray absorption and emission study of [NiFe] hydrogenase model complexes | Q39961806 | ||
Spectroscopic characterization of the isolated iron-molybdenum cofactor (FeMoco) precursor from the protein NifEN | Q41902005 | ||
Identification of a key catalytic intermediate demonstrates that nitrogenase is activated by the reversible exchange of N₂ for H₂. | Q42553068 | ||
A consistent and accurate ab initio parametrization of density functional dispersion correction (DFT-D) for the 94 elements H-Pu | Q43084146 | ||
A functional model for the Rieske center: full characterization of a biomimetic N-ligated [2Fe-2S] cluster in different protonation states. | Q45901930 | ||
Prediction of iron K-edge absorption spectra using time-dependent density functional theory. | Q45985368 | ||
S K-edge X-ray absorption studies of tetranuclear iron-sulfur clusters: mu-sulfide bonding and its contribution to electron delocalization. | Q45998642 | ||
A super-reduced diferrous [2Fe-2S] cluster | Q46503462 | ||
Ligand K-edge X-ray absorption spectroscopy: a direct probe of ligand-metal covalency | Q46775671 | ||
Testing if the interstitial atom, X, of the nitrogenase molybdenum-iron cofactor is N or C: ENDOR, ESEEM, and DFT studies of the S = 3/2 resting state in multiple environments | Q46890112 | ||
Sulfur K-edge X-ray absorption spectroscopy of 2Fe-2S ferredoxin: covalency of the oxidized and reduced 2Fe forms and comparison to model complexes. | Q46944656 | ||
Comparison of iron-molybdenum cofactor-deficient nitrogenase MoFe proteins by X-ray absorption spectroscopy: implications for P-cluster biosynthesis | Q47718286 | ||
Structural, spectroscopic, and redox consequences of a central ligand in the FeMoco of nitrogenase: a density functional theoretical study | Q47789683 | ||
P433 | issue | 9 | |
P407 | language of work or name | English | Q1860 |
P304 | page(s) | 4485-4497 | |
P577 | publication date | 2016-04-20 | |
P1433 | published in | Inorganic Chemistry | Q902828 |
P1476 | title | X-ray Absorption and Emission Spectroscopic Studies of [L2Fe2S2](n) Model Complexes: Implications for the Experimental Evaluation of Redox States in Iron-Sulfur Clusters | |
P478 | volume | 55 |
Q58209164 | A Practical Guide to High-resolution X-ray Spectroscopic Measurements and their Applications in Bioinorganic Chemistry |
Q41671684 | Cobalt Kβ valence-to-core X-ray emission spectroscopy: a study of low-spin octahedral cobalt(iii) complexes |
Q37661209 | Comparative electronic structures of nitrogenase FeMoco and FeVco |
Q50107356 | Electronic and molecular structure relations in diiron compounds mimicking the [FeFe]-hydrogenase active site studied by X-ray spectroscopy and quantum chemistry |
Q28829882 | Experimental and theoretical correlations between vanadium K-edge X-ray absorption and K[Formula: see text] emission spectra |
Q33917569 | Iron L2,3-Edge X-ray Absorption and X-ray Magnetic Circular Dichroism Studies of Molecular Iron Complexes with Relevance to the FeMoco and FeVco Active Sites of Nitrogenase |
Q92248824 | Localized Electronic Structure of Nitrogenase FeMoco Revealed by Selenium K-Edge High Resolution X-ray Absorption Spectroscopy |
Q64258764 | Site-Specific Oxidation State Assignments of the Iron Atoms in the [4Fe:4S] States of the Nitrogenase Fe-Protein |
Q92811368 | Spectroscopic Description of the E1 State of Mo Nitrogenase Based on Mo and Fe X-ray Absorption and Mössbauer Studies |
Q90279034 | Spectroscopic X-ray and Mössbauer Characterization of M6 and M5 Iron(Molybdenum)-Carbonyl Carbide Clusters: High Carbide-Iron Covalency Enhances Local Iron Site Electron Density Despite Cluster Oxidation |
Q90579521 | Theoretical Analysis of Fe K-Edge XANES on Iron Pentacarbonyl |
Q92234490 | X-ray Magnetic Circular Dichroism Spectroscopy Applied to Nitrogenase and Related Models: Experimental Evidence for a Spin-Coupled Molybdenum(III) Center |
Search more.