Publications

2015

Journals

Tang K., Ding W.-L., Höppner A., Zhao C., Zhang L., Hontani Y., Kennis J.T.M., Gärtner W., Scheer H., Zhou M., Zhao K.-H. (2015). The terminal phycobilisome emitter, Lcm: A lightharvesting pigment with a phytochrome chromophore Proceedings of the National Academy of Sciences of the United States of America 112(52), 15880-15885. https://doi.org/10.1073/pnas.1519177113
Botan A., Favela-Rosales F., Fuchs P.F.J., Javanainen M., Kanduč M., Kulig W., Lamberg A., Loison C., Lyubartsev A., Miettinen M.S., Monticelli L., Määttä J., Ollila O.H.S., Retegan M., Róg T., Santuz H., Tynkkynen J. (2015). Toward Atomistic Resolution Structure of Phosphatidylcholine Headgroup and Glycerol Backbone at Different Ambient Conditions Journal of Physical Chemistry B 119(49), 15075-15088. https://doi.org/10.1021/acs.jpcb.5b04878
England J., Bill E., Weyhermüller T., Neese F., Atanasov M., Wieghardt K. (2015). Molecular and Electronic Structures of Homoleptic Six-Coordinate Cobalt(I) Complexes of 2,2′:6′,2″-Terpyridine, 2,2′-Bipyridine, and 1,10-Phenanthroline. An Experimental and Computational Study Inorganic Chemistry 54(24), 12002-12018. https://doi.org/10.1021/acs.inorgchem.5b02415
Braslavsky S.E. (2015). 16^th International Congress on Photobiology (Photobiology-16): Conference Editor's Notes Pure and Applied Chemistry 87(11-12), 1071-1073. https://doi.org/10.1515/pac-2015-5008
Schlögl R. (2015). Green: Editorial Green 5(1-6), 3-5. https://doi.org/10.1515/green-2015-0023
Ristig S., Cibura N., Strunk J. (2015). Manganese Oxides in Heterogeneous (Photo)Catalysis: Possibilities and Challenges Green 5(1-6), 23-41. https://doi.org/10.1515/green-2015-0010
Yi Y., Tornow J., Willinger E., Willinger M.G., Ranjan C., Schlögl R. (2015). Electrochemical Degradation of Multiwall Carbon Nanotubes at High Anodic Potential for Oxygen Evolution in Acidic Media ChemElectroChem 2(12), 1929-1937. https://doi.org/10.1002/celc.201500268 Inside Back Cover
Decaneto E., Suladze S., Rosin C., Havenith M., Lubitz W., Winter R. (2015). Pressure and Temperature Effects on the Activity and Structure of the Catalytic Domain of Human MT1-MMP Biophysical Journal 109(11), 2371-2381. https://doi.org/10.1016/j.bpj.2015.10.023
Velasco-Velez J.J., Pfeifer V., Hävecker M., Weatherup R.S., Arrigo R., Chuang C.-H., Stotz E., Weinberg G., Salmeron M., Schlögl R., Knop-Gericke A. (2015). Photoelectron Spectroscopy at the Graphene-Liquid Interface Reveals the Electronic Structure of an Electrodeposited Cobalt/Graphene Electrocatalyst Angewandte Chemie - International Edition 54(48), 14554 14558. https://doi.org/10.1002/anie.201506044
Saitow M., Kurashige Y., Yanai T. (2015). Fully internally contracted multireference configuration interaction theory using density matrix renormalization group: A reduced-scaling implementation derived by computer-aided tensor factorization Journal of Chemical Theory and Computation 11(11), 5120-5131. https://doi.org/10.1021/acs.jctc.5b00270
Zalibera M., Machata P., Clikeman T.T., Rosenkranz M., Strauss S.H., Boltalina O.V., Popov A.A. (2015). ¹⁹F NMR-, ESR-, and vis-NIR-spectroelectrochemical study of the unconventional reduction behaviour of a perfluoroalkylated fullerene: Dimerization of the C₇₀(CF₃)₁₀-radical anion Analyst 140(21), 7209-7216. https://doi.org/10.1039/c5an01129a
Krewald V., Neese F., Pantazis D.A. (2015). Resolving the Manganese Oxidation States in the Oxygen-evolving Catalyst of Natural Photosynthesis Israel Journal of Chemistry 55(11-12), 1219-1232. https://doi.org/10.1002/ijch.201500051
Carić D., Rakvin B., Kveder M., Junker K., Walde P., Reijerse E. (2015). A multifrequency EPR study of poly(PADPA) synthesized with Trametes versicolor laccase from the aniline dimer p-aminodiphenylamine (PADPA) in the presence of anionic vesicles Current Applied Physics 15, 1516-1520. https://doi.org/10.1016/j.cap.2015.08.023
Qi W., Liu W., Guo X., Schlögl R., Su D. (2015). Oxidative Dehydrogenation on Nanocarbon: Intrinsic Catalytic Activity and Structure-Function Relationships Angewandte Chemie International Edition 54(46), 13682-13685. https://doi.org/10.1002/anie.201505818
Bordignon E., Nalepa A.I., Savitsky A., Braun L., Jeschke G. (2015). Changes in the Microenvironment of Nitroxide Radicals around the Glass Transition Temperature Journal of Physical Chemistry B 119(43), 13797-13806. https://doi.org/10.1021/acs.jpcb.5b04104
Gao Q., Ranjan C., Pavlovic Z., Blume R., Schlögl R. (2015). Enhancement of Stability and Activity of MnO_x/Au Electrocatalysts for Oxygen Evolution through Adequate Electrolyte Composition ACS Catalysis 5(12), 7265-7275. https://doi.org/10.1021/acscatal.5b01632
Suturina E.A., Maganas D., Bill E., Atanasov M., Neese F. (2015). Magneto-Structural Correlations in a Series of Pseudotetrahedral [Co^II(XR)₄]^2- Single Molecule Magnets: An ab Initio Ligand Field Study Inorganic Chemistry 54(20), 9948-9961. https://doi.org/10.1021/acs.inorgchem.5b01706
Beckwith M.A., Ames W., Vila F.D., Krewald V., Pantazis D.A., Mantel C., Pécaut J., Gennari M., Duboc C., Collomb M.-N., Yano J., Rehr J.J., Neese F., DeBeer S. (2015). How Accurately Can Extended X-ray Absorption Spectra Be Predicted from First Principles? Implications for Modeling the Oxygen-Evolving Complex in Photosystem II Journal of the American Chemical Society 137(40), 12815-12834. https://doi.org/10.1021/jacs.5b00783
Meyer S., Krahe O., Kupper C., Klawitter I., Demeshko S., Bill E., Neese F., Meyer F. (2015). A trans-1,2 End-On Disulfide-Bridged Iron-Tetracarbene Dimer and Its Electronic Structure Inorganic Chemistry 54(20), 9770-9776. https://doi.org/10.1021/acs.inorgchem.5b01446
Stavretis S.E., Atanasov M., Podlesnyak A.A., Hunter S.C., Neese F., Xue Z.-L. (2015). Magnetic Transitions in Iron Porphyrin Halides by Inelastic Neutron Scattering and Ab Initio Studies of Zero-Field Splittings Inorganic Chemistry 54(20), 9790-9801. https://doi.org/10.1021/acs.inorgchem.5b01505
Čorić I., Mercado B.Q., Bill E., Vinyard D.J., Holland P.L. (2015). Binding of dinitrogen to an iron-sulfur-carbon site Nature 526, 96-99. doi.org/10.1038/nature15246
Itkis D.M., Velasco-Velez J.J., Knop-Gericke A., Vyalikh A., Avdeev M.V., Yashina L.V. (2015). Probing Operating Electrochemical Interfaces by Photons and Neutrons ChemElectroChem 2(10), 1427-1445. https://doi.org/10.1002/celc.201500155
Pollock C.J., DeBeer S. (2015). Insights into the Geometric and Electronic Structure of Transition Metal Centers from Valence-to-Core X-ray Emission Spectroscopy Accounts of Chemical Research 48(11), 2967-2975. https://doi.org/10.1021/acs.accounts.5b00309
Kiesel S., Wätzlich D., Lange C., Reijerse E., Bröcker M.J., Rüdiger W., Lubitz W., Scheer H., Moser J., Jahn D. (2015). Iron-sulfur cluster-dependent catalysis of chlorophyllide a oxidoreductase from Roseobacter denitrificans Journal of Biological Chemistry 290(2), 1141-1154. https://doi.org/10.1074/jbc.M114.617761
Liakos D.G., Neese F. (2015). Is It Possible to Obtain Coupled Cluster Quality Energies at near Density Functional Theory Cost? Domain-Based Local Pair Natural Orbital Coupled Cluster vs Modern Density Functional Theory Journal of Chemical Theory and Computation 11(9), 4054-4063. https://doi.org/10.1021/acs.jctc.5b00359
Losi A., Mandalari C., Gärtner W. (2015). The Evolution and Functional Role of Flavin-based Prokaryotic Photoreceptors Photochemistry and Photobiology 91(5), 1021-1031. https://doi.org/10.1111/php.12489
Kraiselburd I., Gutt A., Losi A., Gärtner W., Orellano E.G. (2015). Functional Characterization of a LOV-Histidine Kinase Photoreceptor from Xanthomonas citri subsp. citri Photochemistry and Photobiology 91(5), 1123-1132. https://doi.org/10.1111/php.12493
Akimov A., Masitov A., Korchagin D., Chapyshev S., Misochko E., Savitsky A. (2015). W-band EPR studies of high-spin nitrenes with large spin-orbit contribution to zero-field splitting Journal of Chemical Physics 143(8), 84313. https://doi.org/10.1063/1.4929589
Al-Afyouni M.H., Suturina E., Pathak S., Atanasov M., Bill E., Derosha D.E., Brennessel W.W., Neese F., Holland P.L. (2015). Spin Isomers and Ligand Isomerization in a Three-Coordinate Cobalt(I) Carbonyl Complex Journal of the American Chemical Society 137(33), 10689-10699. https://doi.org/10.1021/jacs.5b06078
Slavov C., Xu X., Zhao K.-H., Gärtner W., Wachtveitl J. Detailed insight into the ultrafast photoconversion of the cyanobacteriochrome Slr1393 from Synechocystis sp. Biochimica et Biophysica Acta - Bioenergetics 1847(10), 1335-1344. https://doi.org/10.1016/j.bbabio.2015.07.013
Ogata H., Krämer T., Wang H., Schilter D., Pelmenschikov V., van Gastel M., Neese F., Rauchfuss T.B., Gee L.B., Scott A.D., Yoda Y., Tanaka Y., Lubitz W., Cramer S.P. (2015). Hydride bridge in [NiFe]-hydrogenase observed by nuclear resonance vibrational spectroscopy Nature Communications 6, 7890. https://doi.org/10.1038/ncomms8890
Mondal B., Neese F., Ye S. (2015). Control in the Rate-Determining Step Provides a Promising Strategy To Develop New Catalysts for CO₂ Hydrogenation: A Local Pair Natural Orbital Coupled Cluster Theory Study Inorganic Chemistry 54(15), 7192-7198. https://doi.org/10.1021/acs.inorgchem.5b00469
Tang K., Knipp M., Liu B.-B., Cox N., Stabel R., He Q., Zhou M., Scheer H., Zhao K.-H., Gärtner W. (2015). Redox-dependent ligand switching in a sensory heme-binding GAF domain of the cyanobacterium Nostoc sp. PCC7120 Journal of Biological Chemistry 290, 19067-19080. https://doi.org/10.1074/jbc.M115.654087
Kochem A., Gellon G., Jarjayes O., Philouze C., Du Moulinet D'Hardemare A., van Gastel M., Thomas F. (2015). Nickel(II) radical complexes of thiosemicarbazone ligands appended by salicylidene, aminophenol and aminothiophenol moieties Dalton Transactions 44(28), 12743-12756. https://doi.org/10.1039/c5dt00944h
Kunkes E.L., Studt F., Abild-Pedersen F., Schlögl R., Behrens M. (2015). Hydrogenation of CO₂ to methanol and CO on Cu/ZnO/Al₂O₃: Is there a common intermediate or not? Journal of Catalysis 328, 43-48. https://doi.org/10.1016/j.jcat.2014.12.016
Pinski P., Riplinger C., Valeev E.F., Neese F. (2015). Sparse maps - A systematic infrastructure for reduced-scaling electronic structure methods. I. An efficient and simple linear scaling local MP2 method that uses an intermediate basis of pair natural orbitals Journal of Chemical Physics 143(3), 34108. https://doi.org/10.1063/1.4926879
Weber K., Weyhermüller T., Bill E., Erdem Ö.F., Lubitz W. (2015). Design and Characterization of Phosphine Iron Hydrides: Toward Hydrogen-Producing Catalysts Inorganic Chemistry 54(14), 6928-6937. https://doi.org/10.1021/acs.inorgchem.5b00911
Barnett B.R., Labios L.A., Moore C.E., England J., Rheingold A.L., Wieghardt K., Figueroa J.S. (2015). Solution Dynamics of Redox Noninnocent Nitrosoarene Ligands: Mapping the Electronic Criteria for the Formation of Persistent Metal-Coordinated Nitroxide Radicals Inorganic Chemistry 54(14), 7110-7121. https://doi.org/10.1021/acs.inorgchem.5b01252
Kochem A., O'Hagan M., Wiedner E.S., van Gastel M. (2015). Combined Spectroscopic and Electrochemical Detection of a Ni^I⋯H-N Bonding Interaction with Relevance to Electrocatalytic H₂ Production Chemistry - A European Journal 21(29), 10338-10347. https://doi.org/10.1002/chem.201500954
Law Y.T., Zafeiratos S., Neophytides S.G., Orfanidi A., Costa D., Dintzer T., Arrigo R., Knop-Gericke A., Schlögl R., Savinova E.R. (2015). In situ investigation of dissociation and migration phenomena at the Pt/electrolyte interface of an electrochemical cell Chemical Science 6(10), 5635-5642. https://doi.org/10.1039/c5sc01421b
Barilone J.L., Ogata H., Lubitz W., van Gastel M. (2015). Structural differences between the active sites of the Ni-A and Ni-B states of the [NiFe] hydrogenase: An approach by quantum chemistry and single crystal ENDOR spectroscopy Physical Chemistry Chemical Physics 17(24), 16204-16212. https://doi.org/10.1039/c5cp01322d
Kirchner B., Neese F. (2015). Editorial: Theoretical chemistry developments: From electronic structure to simulations Physical Chemistry Chemical Physics 17(22), 14268-14269. https://doi.org/10.1039/c5cp90040a
Fang H., Jing H.Z., Ge H., Brothers P.J., Fu X., Ye S. (2015). The Mechanism of E-H (E = N, O) Bond Activation by a Germanium Corrole Complex: A Combined Experimental and Computational Study Journal of the American Chemical Society 137(22), 7122-7127. https://doi.org/10.1021/jacs.5b01121
Kowalska J., DeBeer S. (2015). The role of X-ray spectroscopy in understanding the geometric and electronic structure of nitrogenase Biochimica et Biophysica Acta - Molecular Cell Research 1853(6), 1406-1415. https://doi.org/10.1016/j.bbamcr.2014.11.027
Wolff C., Gottschlich A., England J., Wieghardt K., Saak W., Haase D., Beckhaus R. (2015). Molecular and Electronic Structures of Mononuclear and Dinuclear Titanium Complexes Containing π-Radical Anions of 2,2′-Bipyridine and 1,10-Phenanthroline: An Experimental and DFT Computational Study Inorganic Chemistry 54(10), 4811-4820. https://doi.org/10.1021/acs.inorgchem.5b00285
Kühl S., Schumann J., Kasatkin I., Hävecker M., Schlögl R., Behrens M. (2015). Ternary and quaternary Cr or Ga-containing ex-LDH catalysts - Influence of the additional oxides onto the microstructure and activity of Cu/ZnAl₂O₄ catalysts Catalysis Today 246, 92-100. https://doi.org/10.1016/j.cattod.2014.08.029
Liakos D.G., Neese F. (2015). Domain based pair natural orbital coupled cluster studies on linear and folded alkane chains Journal of Chemical Theory and Computation 11(5), 2137-2143. doi.org/10.1021/acs.jctc.5b00265
Lüken A., Muhler M., Strunk J. (2015). On the role of gold nanops in the selective photooxidation of 2-propanol over Au/TiO₂ Physical Chemistry Chemical Physics 17(16), 10391-10397. https://doi.org/10.1039/c4cp05423g
Ogata H., Nishikawa K., Lubitz W. (2015). Hydrogens detected by subatomic resolution protein crystallography in a [NiFe] hydrogenase Nature 520, 571-574. https://doi.org/10.1038/nature14110
Yao S.A., Martin-Diaconescu V., Infante I., Lancaster K.M., Götz A.W., DeBeer S., Berry J.F. (2015). Electronic structure of Ni₂E₂ complexes (E = S, Se, Te) and a global analysis of M₂E₂ compounds: A case for quantized E₂^n- oxidation levels with n= 2, 3, or 4 Journal of the American Chemical Society 137(15), 4993-5011. https://doi.org/10.1021/ja511607j
Kveder M., Rakvin B., Jokić M., Reijerse E. (2015). A comparative study of electron spin decoherence at X- and W-band frequencies as a function of local disorder Journal of Non-Crystalline Solids 414, 27-32. https://doi.org/10.1016/j.jnoncrysol.2015.02.003
Liakos D.G., Sparta M., Kesharwani M.K., Martin J.M.L., Neese F. (2015). Exploring the accuracy limits of local pair natural orbital coupled-cluster theory Journal of Chemical Theory and Computation 11(4), 1525-1539. https://doi.org/10.1021/ct501129s
De Sancho D., Kubas A., Wang P.-H., Blumberger J., Best R.B. (2015). Identification of mutational hot spots for substrate diffusion: Application to myoglobin Journal of Chemical Theory and Computation 11(4), 1919-1927. https://doi.org/10.1021/ct5011455
Lunkenbein T., Schumann J., Behrens M., Schlögl R., Willinger M.G. (2015). Formation of a ZnO Overlayer in Industrial Cu/ZnO/Al₂O₃ Catalysts Induced by Strong Metal-Support Interactions Angewandte Chemie International Edition 54(15), 4544-4548. https://doi.org/10.1002/anie.201411581
Mondal B., Song J., Neese F., Ye S. (2015). Bio-inspired mechanistic insights into CO₂ reduction Current Opinion in Chemical Biology 25, 103-109. https://doi.org/10.1016/j.cbpa.2014.12.022
Zakharova G.V., Zhizhimov D.A., Sazonov S.K., Avakyan V.G., Gromov S.P., Görner H., Chibisov A.K. (2015). Photoprocesses of alkyl meso-thiacarbocyanine dyes in the presence of cucurbit[7]uril Journal of Photochemistry and Photobiology A: Chemistry 302, 69-77. https://doi.org/10.1016/j.jphotochem.2015.01.011
Tomson N.C., Williams K.D., Dai X., Sproules S., DeBeer S., Warren T.H., Wieghardt K. (2015). Re-evaluating the Cu K pre-edge XAS transition in complexes with covalent metal-ligand interactions Chemical Science 6(4), 2474-2487. https://doi.org/10.1039/c4sc03294b
He C.M., Howes B.D., Smulevich G., Rumpel S., Reijerse E.J., Lubitz W., Cox N., Knipp M. (2015). Nitrite dismutase reaction mechanism: Kinetic and spectroscopic investigation of the interaction between nitrophorin and nitrite Journal of the American Chemical Society 137(12), 4141-4150. https://doi.org/10.1021/ja512938u
Kochem A., Weyhermüller T., Neese F., van Gastel M. (2015). EPR and quantum chemical investigation of a bioinspired hydrogenase model with a redox-active ligand in the first coordination sphere Organometallics 34(5), 995-1000. https://doi.org/10.1021/acs.organomet.5b00039
Schlögl R. (2015). Heterogeneous catalysis Angewandte Chemie International Edition 54(11), 3465-3520. https://doi.org/10.1002/anie.201410738
Masters S.L., Robertson H.E., Wann D.A., Hölbling M., Hassler K., Bjornsson R., Wallevik S.Ó., Arnason I. (2015). Molecular structure of 1,2-bis(trifluoromethyl)-1,1,2,2-tetramethyldisilane in the gas, liquid, and solid phases: Unusual conformational changes between phases Journal of Physical Chemistry A 119(9), 1600-1608. https://doi.org/10.1021/jp507744u
Krewald V., Retegan M., Cox N., Messinger J., Lubitz W., DeBeer S., Neese F., Pantazis D.A. (2015). Metal oxidation states in biological water splitting Chemical Science 6(3), 1676-1695. https://doi.org/10.1039/c4sc03720k
Siebel J.F., Adamska-Venkatesh A., Weber K., Rumpel S., Reijerse E., Lubitz W. (2015). Hybrid [FeFe]-hydrogenases with modified active sites show remarkable residual enzymatic activity Biochemistry 54(7), 1474-1483. https://doi.org/10.1021/bi501391d
Shylin S.I., Gural’skiy I.A., Bykov D., Demeshko S., Dechert S., Meyer F., Hauka M., Fritsky I.O. (2015). Iron (II) isothiocyanate complexes with substituted pyrazines: Experimental and theoretical views on their electronic structure Polyhedron 87, 147-155. https://doi.org/10.1016/j.poly.2014.11.016
Martin-Diaconescu V., Gennari M., Gerey B., Tsui E., Kanady J., Tran R., Pécaut J., Maganas D., Krewald V., Gouré E., Duboc C., Yano J., Agapie T., Collomb M.-N., DeBeer S. (2015). Ca K-edge XAS as a probe of calcium centers in complex systems Inorganic Chemistry 54 (4), 1283 1292 https://doi.org/10.1021/ic501991e Cover
Schweinfurth D., Sommer M.G., Atanasov M., Demeshko S., Hohloch S., Meyer F., Neese F., Sarkar B. (2015). The ligand field of the azido ligand: Insights into bonding parameters and magnetic anisotropy in a Co(II)-azido complex Journal of the American Chemical Society 137(5), 1993-2005. https://doi.org/10.1021/ja512232f
Kochem A., Bill E., Neese F., van Gastel M. (2015). Mössbauer and computational investigation of a functional [NiFe] hydrogenase model complex Chemical Communications 51(11), 2099-2102. https://doi.org/10.1039/c4cc09035g
Decaneto E., Abbruzzetti S., Heise I., Lubitz W., Viappiani C., Knipp M. (2015). A caged substrate peptide for matrix metalloproteinases Photochemical and Photobiological Sciences 14(2), 300-307. https://doi.org/10.1039/c4pp00297k
Pennacchietti F., Losi A., Xu X.-L., Zhao K.-H., Gärtner W., Viappiani C., Cella F., Diaspro A., Abbruzzetti S. (2015). Photochromic conversion in a red/green cyanobacteriochrome from Synechocystis PCC6803: Quantum yields in solution and photoswitching dynamics in living E. coli cells Photochemical and Photobiological Sciences 14(2), 229-237. https://doi.org/10.1039/c4pp00337c
Nick T.U., Lee W., Koßmann S., Neese F., Stubbe J., Bennati M. (2015). Hydrogen bond network between amino acid radical intermediates on the proton-coupled electron transfer pathway of E. coli α2 ribonucleotide reductase Journal of the American Chemical Society 137(1), 289-298. https://doi.org/10.1021/ja510513z
Wang M., England J., Weyhermüller T., Wieghardt K. (2015). Electronic structures of "low-valent" neutral complexes [NiL₂]⁰ (S = 0; L = bpy, phen, tpy) - An experimental and DFT computational study (2015). European Journal of Inorganic Chemistry 2015(9), 1511-1523. https://doi.org/10.1002/ejic.201403144
Ricci A., Dramis L., Shah R., Gärtner W., Losi A. (2015). Visualizing the relevance of bacterial blue- and red-light receptors during plant-pathogen interaction Environmental Microbiology Reports 7(5), 795-802. https://doi.org/10.1111/1758-2229.12320
Wang H.X., Yoda Y., Ogata H., Tanaka Y., Lubitz W. (2015). A strenuous experimental journey searching for spectroscopic evidence of a bridging nickel-iron-hydride in [NiFe] hydrogenase Journal of Synchrotron Radiation 22, 1334-1344. https://doi.org/10.1107/S1600577515017816
Barnett B.R., Moore C.E., Chandrasekaran P., Sproules S., Rheingold A.L., DeBeer S., Figueroa J.S. (2015). Metal-only Lewis pairs between group 10 metals and Tl(I) or Ag(I): Insights into the electronic consequences of Z-type ligand binding Chemical Science 6(12), 7169-7178. https://doi.org/10.1039/c5sc03104d
Datta,D., Gauss, J. (2015). Spin densities within a unitary group based spin-adapted open-shell coupled-cluster theory: Analytic evaluation of isotropic hyperfine-coupling constants for the combinatoric open-shell coupled-cluster scheme The Journal of Chemical Physics 143, 011101. https://doi.org/10.1063/1.4923436
Arrigo, R., Schuster, M.E., Xie, Z.L., Yi, Y.M., Wowsnick, G., Sun, L.L., Hermann, K.E., Friedrich, M., Kast, P., Hävecker, M., Knop-Gericke, A., Schlögl, R. (2015). Nature of the N-Pd Interaction in Nitrogen-Doped Carbon Nanotube Catalysts ACS Catalysis 5(5), 2740-2753. https://doi.org/10.1021/acscatal.5b00094
Rees, J.A., Bjornsson, R., Schlesier, J., Sippel, D., Einsle, O., DeBeer, S. (2015). The Fe-V Cofactor of Vanadium Nitrogenase Contains an Interstitial Carbon Atom Angewandte Chemie International Edition 54(45), 13249-13252. https://doi.org/10.1002/anie.201505930
Rodriguez-Maciá, P., Dutta, A., Lubitz, W., Shaw, W.J., Rüdiger, O. (2015). Direct Comparison of the Performance of a Bio-inspired Synthetic Nickel Catalyst and a [NiFe]-Hydrogenase, Both Covalently Attached to Electrodes Angewandte Chemie International Edition 54(42), 12303-12307. https://doi.org/10.1002/anie.201502364
Oughli, A.A., Conzuelo, F., Winkler, M., Happe, T., Lubitz, W., Schuhmann, W., Rüdiger, O., Plumere, N. (2015). A Redox Hydrogel Protects the O2-Sensitive [FeFe]-Hydrogenase from Chlamydomonas reinhardtii from Oxidative Damage Angewandte Chemie International Edition 54(42), 12329-12333. https://doi.org/10.1002/anie.201502776
Lunkenbein, T., Girgsdies, F., Wernbacher, A., Noack, J., Auffermann, G., Yasuhara, A., Klein-Hoffmann, A., Ueda, W., Eichelbaum, M., Trunschke, A., Schlögl, R., Willinger, M.G. (2015). Direct Imaging of Octahedral Distortion in a Complex Molybdenum Vanadium Mixed Oxide Angewandte Chemie International Edition 54(23), 6828-6831. https://doi.org/10.1002/anie.201502236
Schlögl, R. (2015). The Revolution Continues: Energiewende 2.0 Angewandte Chemie International Edition 54(15), 4436-4439. https://doi.org/10.1002/anie.201405876
Kindermann, N., Bill, E., Dechert, S., Demeshko, S., Reijerse, E.J., Meyer, F. (2015). A Ferromagnetically Coupled (S=1) Peroxodicopper(II) Complex Angewandte Chemie International Edition 54(6), 1738-1743. https://doi.org/10.1002/anie.201409709 Frontspiece
Schax, F., Suhr, S., Bill, E., Braun, B., Herwig, C., Limberg, C (2015). A Heterobimetallic Superoxide Complex formed through O₂ Activation between Chromium(II) and a Lithium Cation Angewandte Chemie International Edition 54(4), 1352-1356. https://doi.org/10.1002/anie.201409294
Möbius, K., Savitsky, A., Nalepa, A., Malferrari, M., Francia, F., Lubitz, W., Venturoli, G. (2015). The Magic of Disaccharide Glass Matrices for Protein Function as Decoded by High-Field EPR and FTIR Spectroscopy Applied Magnetic Resonance 46(4), 435-464. https://doi.org/10.1007/s00723-014-0633-4
Barilone, J., Neese, F., van Gastel, M. (2015). Finding the Reactive Electron in Paramagnetic Systems: A Critical Evaluation of Accuracies for EPR Spectroscopy and Density Functional Theory Using 1,3,5-Triphenyl Verdazyl Radical as a Testcase Applied Magnetic Resonance 46(2), 117-139. https://doi.org/10.1007/s00723-014-0627-2
Song, C., Escobar, F.V., Xu, X.L., Narikawa, R., Ikeuchi, M., Siebert, F., Gärtner, W., Matysik, J., Hildebrandt, P. (2015). A Red/Green Cyanobacteriochrome Sustains Its Color Despite a Change in the Bilin Chromophore's Protonation State Biochemistry 54(38), 5839-5848. https://doi.org/10.1021/acs.biochem.5b00735
Kühl, S., Schumann, J., Kasatkin, I., Hävecker, M., Schlögl, R., Behrens, M. (2015). Ternary and quaternary Cr or Ga-containing ex-LDH catalysts-Influence of the additional oxides onto the microstructure and activity of Cu/ZnAl₂O₄ catalysts Catalysis Today 246, 92-100. https://doi.org/10.1016/j.cattod.2014.08.029
Hidese, R., Ataka, K., Bill, E., Shima, S (2015). Cu^Iand H₂O₂ Inactivate and Fe^II Inhibits [Fe]-Hydrogenase at Very Low Concentrations ChemBioChem 16(13), 1861-1865. https://doi.org/10.1002/cbic.201500318
Rumpel, S., Siebel, J.F., Diallo, M., Farès, C., Reijerse, E.J., Lubitz, W. (2015). Structural Insight into the Complex of Ferredoxin and [FeFe] Hydrogenase from Chlamydomonas reinhardtii ChemBioChem 16(11), 1663-1669. https://doi.org/10.1002/cbic.201500130
Studt, F., Behrens, M., Kunkes, E.L., Thomas, N., Zander, S., Tarasov, A., Schumann, J., Frei, E., Varley, J.B., Abild-Pedersen, F., Nørskov, J.K., Schlögl, R. (2015). The Mechanism of CO and CO₂ Hydrogenation to Methanol over Cu-Based Catalysts ChemCatChem 7(7), 1105-1111. https://doi.org/10.1002/cctc.201500123 Back Cover
Roncaroli, F., Bill, E., Friedrich, B., Lenz, O., Lubitz, W., Pandelia, M.E. (2015). Cofactor composition and function of a H₂-sensing regulatory hydrogenase as revealed by Mossbauer and EPR spectroscopy Chemical Science 6(8), 4495-4507. https://doi.org/10.1039/c5sc01560j
Ye, S., Xue, G.Q., Krivokapic, I., Petrenko, T., Bill, E., Que, L., Neese, F. (2015). Magnetic circular dichroism and computational study of mononuclear and dinuclear iron(IV) complexes Chemical Science 6(5), 2909-2921. https://doi.org/10.1039/c4sc03268c
Oehlke, A., Auer, A.A., Schreiter, K., Friebe, N., Spange, S (2015). Highly Lewis Acidic Arylboronate Esters Capable of Colorimetric Turn-On Response Chemistry-A European Journal 21(49), 17890-17896. https://doi.org/10.1002/chem.201500835
Khaletskaya, K., Pougin, A., Medishetty, R., Rösler, C., Wiktor, C., Strunk, J., Fischer, R.A. (2015). Fabrication of Gold/Titania Photocatalyst for CO₂ Reduction Based on Pyrolytic Conversion of the Metal-Organic Framework NH₂-MIL-125(Ti) Loaded with Gold Nanoparticles Chemistry of Materials 27(21), 7248-7257. https://doi.org/10.1021/acs.chemmater.5b03017
Reiche, S., Kowalew, N., Schlögl, R. (2015). Influence of Synthesis pH and Oxidative Strength of the Catalyzing Acid on the Morphology and Chemical Structure of Hydrothermal Carbon ChemPhysChem 16(3), 579-587. https://doi.org/10.1002/cphc.201402834
Atanasov, M., Aravena, D., Suturina, E., Bill, E., Maganas, D., Neese, F. (2015). First principles approach to the electronic structure, magnetic anisotropy and spin relaxation in mononuclear 3d-transition metal single molecule magnets Coordination Chemistry Reviews 289, 177-214. https://doi.org/10.1016/j.ccr.2014.10.015
Maxwell, L., Gómez-Coca, S., Weyhermüller, T., Panyella, D., Ruiz, E (2015). A trinuclear Cu^II complex with functionalized s-heptazine N-ligands: molecular chemistry from a g-C₃N₄ fragment Dalton Transactions 44(36), 15761-15763. https://doi.org/10.1039/c5dt02485d
Lutze, H.V., Bircher, S., Rapp, I., Kerlin, N., Bakkour, R., Geisler, M., von Sonntag, C., Schmidt, T.C. (2015). Degradation of Chlorotriazine Pesticides by Sulfate Radicals and the Influence of Organic Matter Environmental Science & Technology 49(3), 1673-1680. https://doi.org/10.1021/es503496u
Kitschke, P., Ruffer, T., Korb, M., Lang, H., Schneider, W.B., Auer, A.A., Mehring, M. (2015). Intramolecular C-O Insertion of a Germanium(II) Salicyl Alcoholate: A Combined Experimental and Theoretical Study European Journal of Inorganic Chemistry (33), 5467-5479. https://doi.org/10.1002/ejic.201501109
Kitschke, P., Mertens, L., Ruffer, T., Lang, H., Auer, A.A., Mehring, M. (2015). From a Germylene to an "Inorganic Adamantane": [{Ge₄(μ-O)₂(μ -OH)₄}{W(CO)₅}₄]∙4THF European Journal of Inorganic Chemistry (30), 4996-5002. https://doi.org/10.1002/ejic.201500761
Wang, M., Weyhermüller, T., Wieghardt, K. (2015). Determining the Electronic Structure of a Series of [(phen)₃M]0 (M = Ti, V, Mo) and [(pdi)₂M]ⁿ⁺ (M = Cr, Mo) Complexes: Coordination of Neutral Ligands vs. π-Radical Anions European Journal of Inorganic Chemistry (20), 3246-3254. https://doi.org/10.1002/ejic.201500420
Clouston, L.J., Bernales, V., Cammarota, R.C., Carlson, R.K., Bill, E., Gagliardi, L., Lu, C.C. (2015). Heterobimetallic Complexes That Bond Vanadium to Iron, Cobalt, and Nickel Inorganic Chemistry 54(24), 11669-11679. https://doi.org/10.1021/acs.inorgchem.5b01631
Eisenhart, R.J., Carlson, R.K., Clouston, L.J., Young, V.G., Chen, Y.S., Bill, E., Gagliardi, L., Lu, C.C. (2015). Influence of Copper Oxidation State on the Bonding and Electronic Structure of Cobalt-Copper Complexes Inorganic Chemistry 54(23), 11330-11338. https://doi.org/10.1021/acs.inorgchem.5b01950
Thimm, W., Gradert, C., Broda, H., Wennmohs, F., Neese, F., Tuczek, F (2015). Free Reaction Enthalpy Profile of the Schrock Cycle Derived from Density Functional Theory Calculations on the Full [Mo^HIPTN₃N] Catalyst Inorganic Chemistry 54(19), 9248-9255. https://doi.org/10.1021/acs.inorgchem.5b00787
Bykov, D., Neese, F. (2015). Six-Electron Reduction of Nitrite to Ammonia by Cytochrome c Nitrite Reductase: Insights from Density Functional Theory Studies Inorganic Chemistry 54(19), 9303-9316. https://doi.org/10.1021/acs.inorgchem.5b01506
Sundararajan, M., Neese, F. (2015). Distal Histidine Modulates the Unusual O-Binding of Nitrite to Myoglobin: Evidence from the Quantum Chemical Analysis of EPR Parameters Inorganic Chemistry 54(15), 7209-7217. https://doi.org/10.1021/acs.inorgchem.5b00557
Eisenhart, R.J., Rudd, P.A., Planas, N., Boyce, D.W., Carlson, R.K., Tolman, W.B., Bill, E., Gagliardi, L., Lu, C.C. (2015). Pushing the Limits of Delta Bonding in Metal-Chromium Complexes with Redox Changes and Metal Swapping Inorganic Chemistry 54(15), 7579-7592. https://doi.org/10.1021/acs.inorgchem.5b01163
Rees, J.A., Martin-Diaconescu, V., Kovacs, J.A., DeBeer, S. (2015). X-ray Absorption and Emission Study of Dioxygen Activation by a Small-Molecule Manganese Complex Inorganic Chemistry 54(13), 6410-6422. https://doi.org/10.1021/acs.inorgchem.5b00699
Puttock, E.V., Banerjee, P., Kaspar, M., Drennen, L., Yufit, D.S., Bill, E., Sproules, S., Hess, C.R. (2015). A Series of [Co(Mabiq)Cl_2-n] (n=0, 1, 2) Compounds and Evidence for the Elusive Bimetallic Form Inorganic Chemistry 54(12), 5864-5873. https://doi.org/10.1021/acs.inorgchem.5b00636
Maity, S., Kundu, S., Weyhermüller, T., Ghosh, P. (2015). Tris(2,2 '-azobispyridine) Complexes of Copper(II): X-ray Structures, Reactivities, and the Radical Nonradical Bis(ligand) Analogues Inorganic Chemistry 54(4), 1300-1313. https://doi.org/10.1021/ic502750u
Maity, S., Kundu, S., Roy, A.S., Weyhermüller, T., Ghosh, P. (2015). Orthometalation of Dibenzo[1,2]quinoxaline with Ruthenium(II/III), Osmium(II/III/IV), and Rhodium(III) Ions and Orthometalated [RuNO]^6/7 Derivatives Inorganic Chemistry 54(4), 1384-1394. https://doi.org/10.1021/ic502320m
Chaudhuri, S., Kundu, S., Biswas, M.K., Weyhermüller, T., Ghosh, P. (2015). Mononuclear zinc(II), cadmium(II), cobalt(III) and di-nuclear nickel(II) complexes of a 14pi electron diimine ligand: Syntheses, structures, photoluminescence and DFT investigations Inorganic Chimica Acta 430, 199-207. https://doi.org/10.1016/j.ica.2015.02.032
Marcolongo, J.P., Weyhermüller, T., Slep, L.D. (2015). Exploring the photo-stability of the {Ru(py)₄}²⁺ fragment Inorganica Chimica Acta 429, 174-182. https://doi.org/10.1016/j.ica.2014.12.039
Cox, N., Pantazis, D.A., Neese, F., Lubitz, W. (2015). Artificial photosynthesis: understanding water splitting in nature Interface Focus 5(3), 20150009. https://doi.org/10.1098/rsfs.2015.0009
Bjornsson, R., Neese, F., Schrock, R.R., Einsle, O., DeBeer, S. (2015). The discovery of Mo(III) in FeMoco: reuniting enzyme and model chemistry Journal of Biological Inorganic Chemistry 20(2), 447-460. https://doi.org/10.1007/s00775-014-1230-6
Akimov, A., Masitov, A., Korchagin, D., Chapyshev, S., Misochko, E., Savitsky, A. (2015). W-band EPR studies of high-spin nitrenes with large spin-orbit contribution to zero-field splitting Journal of Chemical Physics 143(8), 84313. https://doi.org/10.1063/1.4929589
Demel, O., Pittner, J., Neese, F. (2015). A Local Pair Natural Orbital-Based Multireference Mukherjee's Coupled Cluster Method Journal of Chemical Theory and Computation 11(7), 3104-3114. https://doi.org/10.1021/acs.jctc.5b00334
Krupička, M., Marx, D. (2015). Disfavoring Mechanochemical Reactions by Stress-Induced Steric Hindrance Journal of Chemical Theory and Computation 11(3), 841-846. https://doi.org/10.1021/ct501058a
van Schooneveld, M.M., DeBeer, S. (2015). A close look at dose: Toward L-edge XAS spectral uniformity, dose quantification and prediction of metal ion photoreduction Journal of Electron Spectroscopy and Related Phenomena 198, 31-56. https://doi.org/10.1016/j.elspec.2014.12.001
Hoffman, B.M., Möbius, K. (2015). Tribute to Wolfgang Lubitz Journal of Physical Chemistry B 119(43), 13475-13477. https://doi.org/10.1021/acs.jpcb.5b08583 Festschrift Cover
Rapatskiy, L., Ames, W.M., Pérez-Navarro, M., Savitsky, A., Griese, J.J., Weyhermüller, T., Shafaat, H.S., Hogböm, M., Neese, F., Pantazis, D.A., Cox, N. (2015). Characterization of Oxygen Bridged Manganese Model Complexes Using Multifrequency ¹⁷O-Hyperfine EPR Spectroscopies and Density Functional Theory Journal of Physical Chemistry B 119(43), 13904-13921. https://doi.org/10.1021/acs.jpcb.5b04614
Song, C., Narikawa, R., Ikeuchi, M., Gärtner, W., Matysik, J. (2015). Color Tuning in Red/Green Cyanobacteriochrome AnPixJ: Photoisomerization at C15 Causes an Excited-State Destabilization Journal of Physical Chemistry B 119(30), 9688-9695. https://doi.org/10.1021/acs.jpcb.5b04655
Arnet, N.A., Dugan, T.R., Menges, F.S., Mercado, B.Q., Brennessel, W.W., Bill, E., Johnson, M.A., Holland, P.L. (2015). Synthesis, Characterization, and Nitrogenase-Relevant Reactions of an Iron Sulfide Complex with a Bridging Hydride Journal of the American Chemical Society 137(41), 13220-13223. https://doi.org/10.1021/jacs.5b06841
Adamska-Venkatesh, A., Roy, S., Siebel, J.F., Simmons, T.R., Fontecave, M., Artero, V., Reijerse, E., Lubitz, W. (2015). Spectroscopic Characterization of the Bridging Amine in the Active Site of [FeFe] Hydrogenase Using lsotopologues of the H-Cluster Journal of the American Chemical Society 137(40), 12744-12747. https://doi.org/10.1021/jacs.5b06240
Jiang, S.D., Maganas, D., Levesanos, N., Ferentinos, E., Haas, S., Thirunavukkuarasu, K., Krzystek, J., Dressel, M., Bogani, L., Neese, F., Kyritsis, P. (2015). Direct Observation of Very Large Zero-Field Splitting in a Tetrahedral Ni^IISe₄ Coordination Complex Journal of the American Chemical Society 137(40), 12923-12928. https://doi.org/10.1021/jacs.5b06716
Gilbert-Wilson, R., Siebel, J.F., Adamska-Venkatesh, A., Pham, C.C., Reijerse, E., Wang, H., Cramer, S.P., Lubitz, W., Rauchfuss, T.B. (2015). Spectroscopic Investigations of [FeFe] Hydrogenase Maturated with [⁵⁷Fe₂(adt)(CN)₂(CO)₄]^2- Journal of the American Chemical Society 137(28), 8998-9005. https://doi.org/10.1021/jacs.5b03270
Goswami, M., Lyaskovskyy, V., Domingos, S.R., Buma, W.J., Woutersen, S., Troeppner, O., Ivanovic-Burmazovic, I., Lu, H.J., Cui, X., Zhang, X.P., Reijerse, E.J., DeBeer, S., van Schooneveld, M.M., Pfaff, F.F., Ray, K., de Bruin, B. (2015). Characterization of Porphyrin-Co(III)-'Nitrene Radical' Species Relevant in Catalytic Nitrene Transfer Reactions Journal of the American Chemical Society 137(16), 5468-5479. https://doi.org/10.1021/jacs.5b01197
Fourmond, V., Stapf, S., Li, H.G., Buesen, D., Birrell, J., Rüdiger, O., Lubitz, W., Schuhmann, W., Plumere, N., Léger, C. (2015). Mechanism of Protection of Catalysts Supported in Redox Hydrogel Films Journal of the American Chemical Society 137(16), 5494-5505. https://doi.org/10.1021/jacs.5b01194
Siedschlag, R.B., Bernales, V., Vogiatzis, K.D., Planas, N., Clouston, L.J., Bill, E., Gagliardi, L., Lu, C.C. (2015). Catalytic Silylation of Dinitrogen with a Dicobalt Complex Journal of the American Chemical Society 137(14), 4638-4641. https://doi.org/10.1021/jacs.5b01445
Schlögl, R. (2015). Systemic aspects of the transition to sustainable energy Lectures Notes-Joint EPS-SIF International School on Energy – Course 2 Energy: Basic Concepts and Forefront Ideas 98, 4001. https://doi.org/10.1051/epjconf/20159804001
Rietzschel, N., Pierik, A.J., Bill, E., Lill, R., Mühlenhoff, U. (2015). The Basic Leucine Zipper Stress Response Regulator Yap5 Senses High-Iron Conditions by Coordination of [2Fe-2S] Clusters Molecular and Cellular Biology 35(2), 370-378. https://doi.org/10.1128/MCB.01033-14
Bykov, D., Petrenko, T., Izsák, R., Kossmann, S., Becker, U., Valeev, E., Neese, F. (2015). Efficient implementation of the analytic second derivatives of Hartree-Fock and hybrid DFT energies: a detailed analysis of different approximations Molecular Physics 113(13-14), 1961-1977. https://doi.org/10.1080/00268976.2015.1025114
Dieleman, D., Tombers, M., Peters, L., Meyer, J., Peredkov, S., Jalink, J., Neeb, M., Eberhardt, W., Rasing, T., Niedner-Schatteburg, G., Kirilyuk, A (2015). Orbit and spin resolved magnetic properties of size selected [Co_nRh]⁺ and [Co_nAu]⁺ nanoalloy clusters Physical Chemistry Chemical Physics 17(42), 28372-28378. https://doi.org/10.1039/c5cp01923k
Möbius, K., Plato, M., Klihm, G., Laurich, C., Savitsky, A., Lubitz, W., Szyszko, B., Stępień, M., Latos-Grażyński, L (2015). Möbius-Hückel topology switching in an expanded porphyrin cation radical as studied by EPR and ENDOR spectroscopy Physical Chemistry Chemical Physics 17(9), 6644-6652. https://doi.org/10.1039/c4cp05745g
Adamska-Venkatesh, A., Simmons, TR., Siebel, J.F., Artero, V., Fontecave, M., Reijerse, E., Lubitz, W. (2015). Artificially maturated [FeFe] hydrogenase from Chlamydomonas reinhardtii: a HYSCORE and ENDOR study of a non-natural H-cluster Physical Chemistry Chemical Physics 17(7), 5421-5430. https://doi.org/10.1039/c4cp05426a
Ryding, M.J., Izsák, R., Merlot, P., Reine, S., Helgaker, T., Uggerud, E. (2015). Geometry of the magic number H⁺(H₂O)₂₁ water cluster by proxy Physical Chemistry Chemical Physics 17(7), 5466-5473. https://doi.org/10.1039/c4cp05246c
Braslavsky, S.E. (2015). The history of the IUPAC Symposia on photochemistry - a success story Pure and Applied Chemistry 87(7), 663-705. https://doi.org/10.1515/pac-2015-0402
Bjornsson, R., Delgado-Jaime, M.U., Lima, F.A., Sippel, D., Schlesier, J., Weyhermüller, T., Einsle, O., Neese, F., DeBeer, S. (2015). Molybdenum L-Edge XAS Spectra of MoFe Nitrogenase Zeitschrift für Anorganische und Allgemeine Chemie 641(1), 65-71. https://doi.org/10.1002/zaac.201400446
Chadar, D., Camilles, M., Patil, R., Khan, A., Weyhermülller, T., Salunke-Gawali, S. (2015). Synthesis and characterization of n-alkylamino derivatives of vitamin K3: Molecular structure of 2-methyl-3-(n-propylamino)-1,4-naphthoquinone and antibacterial activities Journal of Molecular Structure 1086, 179-189. https://doi.org/10.1016/j.molstruc.2015.01.029
Chadar, D., Rao, S.S., Khan, A., Gejji, S.P., Bhat, K.S., Weyhermüller, T., Salunke-Gawali, S. (2015). Benzo[α]phenoxazines and Benzo[α]phenothiazine from Vitamin K3: Synthesis, Molecular Structures, DFT Studies and Cytotoxic Activity RSC Advances 5(71), 57917-57929. https://doi.org/10.1039/c5ra08496b
Pal, S., Konkimalla, V.B., Kathawate, L., Rao, S.S., Gejii, S.P., Puranik, V.G., Weyhermüller, T., Salunke-Gawali, S. (2015). Targeting chemorefractory COLO205 (BRAF V600E) cell lines using substituted benzo[α]phenoxazines RSC Advances 5(100), 82549-82263. https://doi.org/10.1039/c5ra14949e
Ware, A.P., Patil, A., Klomane, S., Weyhermüller, T., Pingale, S.S., Salunke-Gawali, S. (2015). Naphthoquinone based chemosensor 2-(2'-aminomethylpyridine)-3-chloro-1,4-naphthoquinone for metal ions: Single crystal X-ray structure, experimental and TD-DFT study Journal of Molecular Structure 1093, 39-48. https://doi.org/10.1016/j.molstruc.2015.03.016
Gennari, M., Brazzolotto, D., Pécaut, J., Cherrier, M.V., Pollock, C.J., DeBeer, S., Retegan, M., Pantazis, D.A., Neese, F., Rouziéres, Clérac, R., Duboc, C. (2015). Dioxygen Activation and Catalytic Reduction to Hydrogen Peroxide by a Thiolate-Bridged Dimanganese(II) Complex with a Pendant Thiol Journal of the American Chemical Society 137(26), 8644-8653. https://doi.org/10.1021/jacs.5b04917

Book chapters

Krewald V., Retegan M., Pantazis D.A. (2015). Principles of natural photosynthesis Solar Energy for Fuels. Topics in Current Chemistry 371, 23- 48. https://doi.org/10.1007/128_2015_645
DeBeer, S. (2015). Biological Catalysts High-resolution XAS/XES: Analyzing Electronic Structures of Catalysts 153-167. https://doi.org/10.1201/b17184
Cox, N., Nalepa, A., Pandelia, M.E., Lubitz, W., Savitsky, A. (2015). Pulse Double-Resonance EPR Techniques for the Study of Metallobiomolecules Methods in Enzymology: Electron Paramagnetic Resonance Investigations of Biological Systems by Using Spin Labels, Spin Probes, and Intrinsic Metal Ions, Part A 563, 211-249. https://doi.org/10.1016/bs.mie.2015.08.016