"From inert gas to fertilizer, fuel and fine chemicals: N2 reduction and fixation", Braun, A.; Bora, D. K.; Lauterbach, L.; Lettau, E.; Wang, H.; Cramer, S. P.; Yang, F.; Guo, J. Catalysis Today, 2021, accepted, in press. (pdf)

"Nuclear Resonance Vibrational Spectroscopy: A Modern Tool to Pinpoint Site-Specific Cooperative Processes", Wang, H. X.; Braun, A.; Cramer, S. P.; Gee, L. B.; Yoda, Y. Crystals, 2021, 11, 909. (pdf)

"NRVS and DFT of MitoNEET – Understanding the Special Vibrational Structure of a [2Fe-2S] Cluster Protein with (Cys3)(His)1 Ligation", Gee, L. B.; Pelmenschikov, V.; Mons, C.; Mishra, N.; Wang, H.; Yoda, Y.; Tamasaku, K.; Golinelli-Cohen, M.-P.; Cramer, S. P. Biochemistry, 2021, 60, 2419-2424. (pdf)

"Vibrational Perturbation of the [FeFe] Hydrogenase H-Cluster Revealed by 13C2HADT Labeling", Pelmenschikov, V.; Birrell, J. A.; Gee, L.; Richers, C. P.; Reijerse, E. J.; Wang, H.; Arragain, S.; Mishra, N.; Yoda, Y.; Matsuura, H.; Li, L.; Tamasaku, K.; Rauchfuss, T. B.; Lubitz, W.; Cramer, S. P. J. Am. Chem. Soc., 2021, 143, 8237–8243. (pdf)

"Exploring Structure and Function of Redox Intermediates in NiFe-Hydrogenases by an Advanced Experimental Approach for Solvated, Lyophilized and Crystallized Metalloenzymes", Lorent, C.; Pelmenschikov, V.; Frielingsdorf, S.; Schoknecht, J.; Caserta, G.; Yoda, Y.; Wang, H.; Tamasaku, K.; Lenz, O.; Cramer, S. P.; Horch, M.; Lauterbach, L.; Zebger, I. Ang. Chem. Int. Ed., 2021, 60, 15854-15862. (pdf)

"Hydroxy-bridged resting states of a NiFe -hydrogenase unraveled by cryogenic vibrational spectroscopy and DFT computations", Caserta, G.; Pelmenschikov, V.; Lorent, C.; Waffo, A. F. T.; Katz, S.; Lauterbach, L.; Schoknecht, J.; Wang, H.; Yoda, Y.; Tamasaku, K.; Kaupp, M.; Hildebrandt, P.; Lenz, O.; Cramer, S. P.; Zebger, I. Chem. Sci., 2021, 12, 2189-2197. (pdf)

"High-Frequency Fe-H Stretching Modes and Fe-H2 Modes in a trans-57Fe(η2-H2)(H) Complex: A Speed Record for Nuclear Resonance Vibrational Spectroscopy", Chiang, M.-H.; Pelmenschikov, V.; Gee, L. B.; Liu, Y.-C.; Hsieh, C.-C.; Wang, H.; Yoda, Y.; Matsuura, H.; Li, L.; Cramer, S. P. Inorg. Chem., 2021, 60, 555-559. (pdf)

"Assignment of protonated R-homocitrate in extracted FeMo-cofactor of nitrogenase via vibrational circular dichroism spectroscopy", Deng, L.; Wang, H.; Dapper, C. H.; Newton, W. E.; Shilov, S.; Wang, S.; Cramer, S. P.; Zhou, Z. H. Comm. Chem., 2020, 3, 1-7. (pdf)

"In vitro assembly as a new tool to investigate catalytic intermediates of [NiFe]-hydrogenase", Caserta, G.; Lorent, C.; Pelmenschikov, V.; Schoknecht, J.; Yoda, Y.; Hildebrandt, P.; Cramer, S. P.; Zebger, I.; Lenz, O., ACS Catalysis, 2020, 10, 13890-13894. (pdf)

"Nuclear Resonance Vibrational Spectroscopy", Gee, L. B.; Wang, H.; Cramer, S. P., in Bioorganometallic Chemistry; Apfel, U.-P. and Weigand, W., Ed.; De Gruyter: Berlin, 2020353-394. (pdf)

"Caught in the Hinact: Crystal Structure and Spectroscopy Reveal a Sulfur Bound to the Active Site of an O2-stable State of [FeFe] Hydrogenase", Rodríguez-Maciá, P.; Galle, L. M.; Bjornsson, R.; Lorent, C.; Zebger, I.; Yoda, Y.; Cramer, S. P.; DeBeer, S.; Span, I.; Birrell, J. A., Ang. Chem. Int. Ed., 2020, 59, 2-11. (pdf)

"The large subunit of the regulatory [NiFe]-hydrogenase from Ralstonia eutropha – a minimal hydrogenase?", Caserta, G.; Lorent, C.; Ciaccafava, A.; Keck, M.; Breglia, R.; Greco, C.; Limberg, C.; Hildebrandt, P.; Cramer, S. P.; Zebger, I.; Lenz, O., Chem. Sci., 2020, 11, 5453-5465. (pdf)

"X-Ray Spectroscopy with Synchroton Radiation — Fundamentals and Applications", Cramer, S. P., Springer Nature Switzerland: Switzerland, 2020. (pdf)

"Vibrational and electronic characterization of a diiron bridging hydride complex – a model for hydrogen catalysis", Gee, L. B.; Pelmenschikov, V.; Wang, H.; Mishra, N.; Liu, Y.-C.; Yoda, Y.; Tamasaku, K.; Chiang, M.-H.; Cramer, S. P., JACS. 2020, 142, 222-232. (pdf)

"Spectroscopic and Computational Evidence that [FeFe] Hydrogenases Operate Exclusively with CO-Bridged Intermediates", Birrell, J.A.; Pelmenschikov, V.; Mishra, N.; Wang, H.; Yoda, Y.; Tamasaku, K.; Rauchfuss, T.; Cramer, S.P.; Lubitz, W.; DeBeer, S., JACS. 2020, 142, 222-232. (pdf)

"Scientific Opportunities with an X-ray Free-Electron Laser Oscillator", Adams, et. al., arXiv:1903.09317v2. 2019. (pdf)

"Asymmetry in the Ligand Coordination Sphere of the [FeFe] Hydrogenase Active Site Is Reflected in the Magnetic Spin Interactions of the Aza-propanedithiolate Ligand", Reijerse, E. J.; Pelmenschikov, V.; Birrell, J. A.; Richers, C. P.; Kaupp, M.; Rauchfuss, T.; Cramer, S. P.; Lubits W., J. Phys. Chem. Lett.. 2019, 10, 6794-6799. (pdf)

"Insights from 125Te and 57Fe nuclear resonance vibrational spectroscopy: a [4Fe�4Te] cluster from two points of view", Wittkamp, F.; Mishra, N.; Wang, H.; Wille, H.-C.; Steinbrugge, R.; Kaupp M.;Cramer, S. P.; Apfel, U.-P.; Pelmenschikov, V., Chem. Sci. 2019, 10, 7535-7541. (pdf)

"Preliminary Assignment of Protonated and Deprotonated Homocitrates in Extracted FeMo-Cofactors by Comparisons with Molybdenum(IV) Lactates and Oxidovanadium Glycolates", Jin, W.-T.; Wang H.; Wang S.-Y.; Dapper C. H.; Xing L.; Newton, W. E.; Zhou, Z.-H.; Cramer, S. P., Inorg. Chem. 2019, 58, 2523-2532. (pdf)

"High-Frequency Fe–H Vibrations in a Bridging Hydride Complex Characterized by NRVS and DFT", Pelmenschikov, V.; Gee L. B.; Wang, H.; MacLeod, K. C.; McWilliams, S. F.; Skubi K. L.;Cramer, S. P.; Holland P. L., Angew Chem Int Ed Engl. 2018, 57, 9367-9371. (pdf)

"Terminal Hydride Species in [FeFe]-Hydrogenases Are Vibrationally Coupled to the Active Site Environment", Pham, C. C.; Mulder, D. W.; Pelmenschikov, V.; King, P. W.; Ratzloff, M. W.; Wang, H.; Mishra, N.; Alp, E. E.; Zhao, J.; Hu, M. Y.; Tamasaku, K.; Yoda, Y.; Cramer, S. P., Angew Chem Int Ed Engl. 2018, 218, 30-34. (pdf)

"Cluster-Dependent Charge-Transfer Dynamics in Iron-Sulfur Proteins", Mao, Z.; Liou, S. H.; Khadka, N.; Jenney, F. E., Jr.; Goodin, D. B.; Seefeldt, L. C.; Adams, M. W. W.; Cramer, S. P.; Larsen, D. S., Biochemistry, 2018, 57 (6), 978-990. (pdf)

"NRVS for Fe in Biology: Experiment and Basic Interpretation", Gee, L. B.; Wang, H.; Cramer, S. P., Methods Enzymol., 2018, 599, 409-425. (pdf)

"Sterically Stabilized Terminal Hydride of a Diiron Dithiolate", Carlson, M. R.; Gray, D. L.; Richers, C. P.; Wang, W.; Zhao, P. H.; Rauchfuss, T. B.; Pelmenschikov, V.; Pham, C. C.; Gee, L. B.; Wang, H.; Cramer, S. P., Inorg Chem, 201857 (4), 1988-2001(pdf)

"Enzymatic and spectroscopic properties of a thermostable [NiFe]hydrogenase performing H2-driven NAD(+)-reduction in the presence of O2", Preissler, J.; Wahlefeld, S.; Lorent, C.; Teutloff, C.; Horch, M.; Lauterbach, L.; Cramer, S. P.; Zebger, I.; Lenz, O., Biochim Biophys Acta, 2018, 1859 (1), 8-18 (pdf)

"Ultrafast Charge-Transfer Dynamics in the Iron-Sulfur Complex of Rhodobacter capsulatus Ferredoxin VI", Mao, Z.; Carroll, E. C.; Kim, P. W.; Cramer, S. P.; Larsen, D. S., J Phys Chem Lett, 2017, 8 (18), 4498-4503. (pdf)

"Reaction Coordinate Leading to H2 Production in [FeFe]-Hydrogenase Identified by Nuclear Resonance Vibrational Spectroscopy and Density Functional Theory", Pelmenschikov, V.; Birrell, J. A.; Pham, C. C.; Mishra, N.; Wang, H.; Sommer, C.; Reijerse, E.; Richers, C. P.; Tamasaku, K.; Yoda, Y.; Rauchfuss, T. B.; Lubitz, W.; Cramer, S. P., J Am Chem Soc, 2017139 (46), 16894-16902.(pdf)

"Temperature and radiation effects at the fluorine K-edge in LiF", Schwartz, C. P.; Ponce, F.; Friedrich, S.; Cramer, S. P.; Vinson, J.; Prendergast, D. J. Elect. Spect. Rel. Phen., 2017, 218, 30-34.(pdf)

"Spectroscopic and Computational Investigations of Ligand Binding to IspH: Discovery of Non-diphosphate Inhibitors", O'Dowd, B.; Williams, S.; Wang, H. X.; No, J. H.; Rao, G. D.; Wang, W. X.; McCammon, J. A.; Cramer, S. P.; Oldfield, E. Chembiochem, 2017, 18, 914-920. (pdf)

"Direct observation of an iron bound terminal hydride intermediate in [FeFe] hydrogenase", Reijerse, E. J.; Pham, C. C.; Pelmenschikov, V.; Gilbert-Wilson, R.; Adamska-Venkatesh, A.; Siebel, J. F.; Gee, L. B.; Yoda, Y.; Tamasaku, K.; Lubitz, W.; Rauchfuss, T. B.; Cramer, S. P. J. Am. Chem. Soc., 2017, 139, 4306-4309. (pdf)

"Asymmetric Synthesis of Homocitric Acid Lactone", Nickerson, L. A.; Huynh, V.; Balmond, E. I.; Cramer, S. P.; Shaw, J. T. J. Org. Chem., 2016, 81, 11404-11408. (pdf)

"Is trehalose an effective quenching agent of Azotobacter vinelandii Mo nitrogenase turnover?", Gee, L. B.; Scott, A. D.; Dapper, C. H.; Newton, W. E.; Cramer, S. P. Inorg. Chim. Acta, 2016, 453, 74-77. (pdf)

"High-resolution monochromator for iron nuclear resonance vibrational spectroscopy of biological samples", Yoda, Y.; Okada, K.; Wang, H.; Cramer, S. P.; Seto, M. Jap. J. App. Phys., 2016, 55, 122401. (pdf)

"Nitrosylation of Nitric-Oxide-Sensing Regulatory Proteins Containing [4Fe-4S] Clusters Gives Rise to Multiple Iron-Nitrosyl Complexes", Serrano, P. N.; Wang, H.; Crack, J. C.; Prior, C.; Hutchings, M. I.; Thomson, A. J.; Kamali, S.; Yoda, Y.; Zhao, J.; Hu, M. Y.; Alp, E. E.; Oganesyan, V. S.; Brun, N. E. L.; Cramer, S. P. Angew. Chem. Int. Ed., 2016, 55, 14575-14579. (pdf)

"Synchrotron-based Nickel Mössbauer Spectroscopy", Gee, L. B.; Lin, C.-Y.; Jr., F. E. J.; Yoda, Y.; Masuda, R.; Saito, M.; Kobayashi, Y.; Tamasaku, K.; Seto, M.; Charles G. Riordan; Ploskonka, A.; Power, P. P.; Cramer, S. P.; Lauterbach, L. Inorg. Chem., 2016, 55I, 6866-6872. (pdf)

"Characterization of the 3Fe-4S0/1+ cluster from the D14C variant of Pyrococcus furiosus ferredoxin via combined NRVS and DFT analyses", Lauterbach, L.; Gee, L. B.; Pelmenschikov, V.; Jenney, F. E.; Kamali, S.; Yoda, Y.; Adams, M. W. W.; Cramer, S. P. Dalton Trans., 2016, 45, 7215-7219. (pdf)

"The Radical SAM Enzyme HydG Requires Cysteine and a Dangler Iron for Generating an Organometallic Precursor to the FeFe Hydrogenase H-Cluster", Suess, D.; Pham, C.; Bürstel, I.; Swartz, J.; Cramer, S.; Britt, R. D. J. Am. Chem. Soc., 2016, accepted, in press. (pdf)

"Low Frequency Dynamics of Nitrogenase via Femtosecond Pump Probe Spectroscopy �?? Observation of a Candidate Promoting Vibration", Cerullo, G.; Delfino, I.; Manzoni, C.; Gee, L.; Dapper, C.; Newton, W. E.; Cramer, S. P. J. Inorg. Biochem., 2016, 151-152, in press, available online. (pdf)

"Free Cysteine as a Ligand Platform in the Bioassembly of the FeFe Hydrogenase H-Cluster", Suess, D. L. M.; Bu�?rstel, I.; Paz, L. D. L.; Kuchenreuther, J. M.; Pham, C.; Cramer, S. P.; Swartz, J. R.; Britt, R. D. Proc. Nat. Acad. Sci., 2015, 112, 11455-11460. (pdf)

"Spectroscopic investigations of [FeFe] hydrogenase maturated with[57Fe2(adt)(CN)2(CO)4]2-", Gilbert-Wilson, R.; Siebel, J.; Pham, C.; Agnieszka, A.-V.; Edward, R.; Wang, H.; Cramer, S.; Lubitz, W.; Rauchfuss, T. J. Am. Chem. Soc., 2015, 137, 8998-9005. (pdf)

"Docking and Migration of Carbon Monoxide in Nitrogenase �?? The Case for Gated Pockets from IR Spectroscopy and Molecular Dynamics", Gee, L. B.; Leontyev, I.; Scott, A. D.; Pelmentschikov, V.; Stuchebrukhov, A.; Cramer, S. P. Biochemistry, 2015, 54, 3314-3319 (pdf)

"NsrR from Streptomyces coelicolor is a NO-sensing [4Fe-4S] cluster protein with a specialised regulatory function", Crack, J. C.; Munnoch, J.; Dodd, E.; Knowles, F.; Bassam, M. M. A.; Kamali, S.; Holland, A. A.; Cramer, S. P.; Hamilton, C.; Johnson, M. K.; Thomson, A. J.; Hutchings, M. I.; Brun, N. E. L. J. Biol. Chem., 2015, 290, 12689-12704. (pdf)

"A Hydride Bridge in Fully Reduced [NiFe] Hydrogenase �??Evidence from Nuclear Resonance Vibrational Spectroscopy (NRVS) and DFT Calculations", Ogata, H.; Kraemer, T.; Hongxin Wang; Gastel, M. v.; Neese, F.; Rauchfuss, T.; Schilter, D.; Pelmenschikov, V.; Gee, L.; Aubrey Scott; Yoshitaka Yoda; Yoshito, T.; Lubitz, W.; Cramer, S. P. Nature Chem. Biol., 2014, prepared for submission. (pdf)

"Nuclear resonance vibrational spectroscopy reveals the FeS cluster composition and active site vibrational properties of a NAD+-reducing [NiFe] hydrogenase", Lauterbach, L.; Wang, H.; Horch, M.; Gee, L. B.; Yoda, Y.; Tanaka, Y.; Zebger, I.; Lenz, O.; Cramer, S. Chem. Sci., 2014 submitted. (pdf)

"Structural Characterization of CO-Inhibited Mo-Nitrogenase by Combined Application of NRVS, EXAFS, and DFT: New Insights into the Effects of CO Binding and the Role of the Interstitial Atom", Scott, A.; Pelmenschikov, V.; Guo, Y.; Wang, H.; Yan, L.; George, S.; Dapper, C.; Newton, W.; Yoda, Y.; Tanaka, Y.; Cramer, S. P. J. Am. Chem. Soc., 2014 Accepted. (pdf)

"Synthesis and Vibrational Spectroscopy of 57Fe-Labeled Models of [NiFe] Hydrogenase: First Direct Observation of a Nickel-Iron Interaction" , Schilter, D.; Wang, H.; Pelmenschikov, V.; Gee, L. B.; Yoda, Y.; Cramer, S. P. Chem. Comm., 2014, 50, 13469-13472. (pdf)

"α-Hydroxy coordination of mononuclear vanadyl citrate, malate and S-citramalate with N�??heterocycle ligand, implying a new protonation pathway of iron-vanadium cofactor in nitrogenase", Chen, C.-Y.; Chen, M.-L.; Chen, H.-B.; Wang, H.; Cramer, S. P.; Zhou, Z.-H. J. Inorg. Biochem., 2014, 141, 114-120. (pdf)

"A Practical Guide for Nuclear Resonance Vibrational Spectroscopy (NRVS) of Biochemical Samples and Model Compounds", Wang, H.; Alp, E. E.; Yoda, Y.; Cramer, S. P., in Metalloproteins: Methods and Protocols; Fontecilla-Camps, J. C. and Nicolet, Y., Ed.; Springer - Humana Press, 2014; Vol. 1122, pp. 125-138. (pdf)

"The HydG Enzyme Generates an Fe(CO)2(CN) Synthon in Assembly of the FeFe Hydrogenase H-Cluster", Kuchenreuther, J. M.; Myers, W. K.; Suess, D. L. M.; Stich, T. A.; Pelmenschikov, V.; Shiigi, S. A.; Cramer, S. P.; Swartz, J. R.; Britt, R. D.; George, S. J. Science, , 2014, 343, 424-427. (pdf)

"Fe-S Cluster Biogenesis in Gram-Positive Bacteria: SufU Is a Zinc-Dependent Sulfur Transfer Protein", Selbach, B. P.; Chung, A. H.; Scott, A. D.; George, S. J.; Cramer, S. P.; Dos Santos, P. C. Biochemistry, 2014, 53, 152-160. (pdf)

"Enantioselective Synthesis of Isotopically Labeled Homocitric Acid Lactone", Moore, J.; Hanhan, N.; Mahoney, M.; Cramer, S.; Shaw, J. Org. Lett., 2013, 15, 5615-5617. (pdf)
"Synchrotron Radiation Based Nuclear Resonant Scattering: Applications to Bioinorganic Chemistry", Guo, Y.; Yoda, Y.; Zhang, X.; Xiao, Y.; Cramer, S. P., in Mössbauer Spectroscopy: Applications in Chemistry, Biology, Industry, and Nanotechnology; Sharma, V. K., Klingelhofer, G. and Nishida, T., Ed.; Wiley, 2013, 20, 614-619. (pdf)
"Soft X-ray absorption spectroscopy and resonant inelastic X-ray scattering spectroscopy below 100 eV: probing first-row transition-metal M-edges in chemical complexes", Wang, H. X.; Young, A. T.; Guo, J. H.; Cramer, S. P.; Friedrich, S.; Braun, A.; Gu, W. W. J. Synchrotron Rad., 2013, 20, 614-619. (pdf)