Publications

Publications listed in which all or part the research was carried out using EMSL resources.

2021

Cao X., L. Zou, B.E. Matthews, L. Zhang, X. He, X. Ren, and M.H. Engelhard, et al. 2021. "Optimization of fluorinated orthoformate based electrolytes for practical high-voltage lithium metal batteries." Energy Storage Materials 34. PNNL-SA-153014. doi:10.1016/j.ensm.2020.08.035

2020

Leier H.C., J.B. Weinstein, J.E. Kyle, J. Lee, L.M. Bramer, K.G. Stratton, and D. Kempthorne, et al. 2020. "A global lipid map defines a network essential for Zika virus replication." Nature Communications 11, no. 3652. PNNL-SA-139745. doi:10.1038/s41467-020-17433-9
Leier H.C., J.B. Weinstein, J.E. Kyle, K.G. Stratton, J. Lee, L.M. Bramer, and D. Kempthorne, et al. 2020. "A global lipid map reveals a network essential for Zika virus replication." Nature Communications. PNNL-SA-148085. doi:10.1101/2020.01.27.910919
Wang H., Y. Shao, H. Pan, X. Feng, Y. Chen, Y. Liu, and E.D. Walter, et al. 2020. "A lithium-sulfur battery with a solution-mediated pathway operating under lean electrolyte conditions." Nano Energy 76. PNNL-SA-143093. doi:10.1016/j.nanoen.2020.105041
Bard A., X. Zhou, X. Xia, G. Zhu, M.B. Lim, S. Kim, and M.C. Johnson, et al. 2020. "A Mechanistic Understanding of Nonclassical Crystal Growth in Hydrothermally Synthesized Sodium Yttrium Fluoride Nanowires." Chemistry of Materials 32, no. 7:2753-2763. PNNL-SA-147967. doi:10.1021/acs.chemmater.9b04076
Ling F.T., J.E. Post, P.J. Heaney, C.M. Santelli, E.S. Ilton, W.D. Burgos, and A.W. Rose. 2020. "A multi-method characterization of natural terrestrial birnessites." The American Mineralogist 105, no. 6:833-847. PNNL-SA-149385. doi:10.2138/am-2020-7303
Chowdhury A.J., W. Yang, K.E. Abdelfatah, M. Zare, A. Heyden, and G.A. Terejanu. 2020. "A Multiple Filter Based Neural Network Approach to the Extrapolation of Adsorption Energies on Metal Surfaces for Catalysis Applications." Journal of Chemical Theory and Computation 16, no. 2:1105â1114. doi:10.1021/acs.jctc.9b00986
Xie Y., Y. Feng, A. Di Capua, T. Mak, G.W. Buchko, P.J. Myler, and M. Lui, et al. 2020. "A Phenotarget Approach for Identifying an Alkaloid Interacting with the Tuberculosis Protein Rv1466." Marine Drugs 18, no. 3:149. PNNL-SA-150251. doi:10.3390/md18030149
Zhang T., M.J. Gaffrey, D.G. Thomas, T.J. Weber, B.M. Hess, K.K. Weitz, and P.D. Piehowski, et al. 2020. "A proteome-wide assessment of the oxidative stress paradigm for metal and metal-oxide nanomaterials in human macrophages." NanoImpact 17. PNNL-SA-147217. doi:10.1016/j.impact.2019.100194
Bagus P.S., C.R. Brundle, and E.S. Ilton. 2020. "A Rigorous Non-Empirical Theoretical Analysis of the 2p XPS of NiO: Is it Necessary to Invoke Nonlocal Screening?." Journal of Electroanalytical Chemistry. PNNL-SA-149146. doi:10.1016/j.jelechem.2020.114135
Li A., V. Garimella, and Y.M. Ibrahim. 2020. "A Simulation Study of the Influence of the Traveling Wave Patterns on Ion Mobility Separations in Structures for Lossless Ion Manipulations." Analyst 145, no. 1:240-248. PNNL-SA-145853. doi:10.1039/C9AN01509D
Kerisit S.N., and M.P. Prange. 2020. "Ab initio molecular dynamics simulation of Nd3+ incorporation in calcite." Chemical Geology 534. PNNL-SA-147075. doi:10.1016/j.chemgeo.2019.119460
Schilling A.C., K.J. Groden, J.P. Simonovis, A. Hunt, R.T. Hannagan, V. Cinar, and J. McEwen, et al. 2020. "Accelerated Cu2O Reduction by Single Pt Atoms at the Metal-Oxide InterfaceÂ§." ACS Catalysis 10, no. 7:4215â4226. PNNL-SA-151943. doi:10.1021/acscatal.9b05270
Wang X., A.C. Swensen, T. Zhang, P.D. Piehowski, M.J. Gaffrey, M.E. Monroe, and Y. Zhu, et al. 2020. "Accurate Identification of Deamidation and Citrullination from Global Shotgun Proteomics Data Using a Dual-search Delta Score Strategy." Journal of Proteome Research 19, no. 4:1863-1872. PNNL-SA-149222. doi:10.1021/acs.jproteome.9b00766
Marcinkowski M.D., K.C. Adamsen, N.M. Doudin, M.A. Sharp, R.S. Smith, Y. Wang, and S. Wendt, et al. 2020. "Adsorption and Reaction of Methanol on Fe3O4(001)." Journal of Chemical Physics 152, no. 6:Article No. 064703. PNNL-SA-149459. doi:10.1063/1.5139418
Zhang X., L. Zou, Y. Xu, X. Cao, M.H. Engelhard, B.E. Matthews, and L. Zhong, et al. 2020. "Advanced electrolytes for fast-charging high-voltage lithium-ion batteries in wide-temperature range." Advanced Energy Materials 10, no. 22:2000368. PNNL-SA-150274. doi:10.1002/aenm.202000368
Wang H., R.C. Easter, R. Zhang, P. Ma, B. Singh, K. Zhang, and D. Ganguly, et al. 2020. "Aerosols in the E3SM Version 1: New Developments and Their Impacts on Radiative Forcing." Journal of Advances in Modeling Earth Systems 12, no. 1:Article No. e2019MS001851. PNNL-SA-146124. doi:10.1029/2019MS001851
Martinez Baez E., R. Feng, C.I. Pearce, G.K. Schenter, and A.E. Clark. 2020. "AI-27 NMR chemical shift of Al(OH)4- calculated from first principles: Assessment of error cancellation in chemically distinct reference and target systems." Journal of Chemical Physics 152, no. 13:Article No. 134303. PNNL-SA-150302. doi:10.1063/1.5144294
Zhao Y., M. Song, X. Yang, J. Yang, G. Wang, J. Yi, and G. Shan, et al. 2020. "Amorphous Ag2-xCuxS Quantum Dots: "all-in-one" theranostic nanomedicines for near-infrared fluorescence/photoacoustics dual-modal-imaging-guided photothermal therapy." Chemical Engineering Journal 399. PNNL-SA-140492. doi:10.1016/j.cej.2020.125777
Velickovic D., V.S. Lin, A. Rivas-Ubach, C.R. Anderton, and J.J. Moran. 2020. "An approach for broad molecular imaging of the root-soil interface via indirect matrix-assisted laser desorption/ionization mass spectrometry." Soil Biology and Biochemistry 146. PNNL-SA-150080. doi:10.1016/j.soilbio.2020.107804
Garcellano R.C., J.R. Cort, S. Moinuddin, S.G. Fransblau, R. Ma, and A.M. Aguinaldo. 2020. "An iboga alkaloid chemotaxonomic marker from endemic Tabernaemontana ternifolia with antitubercular activity." Natural Product Research 34, no. 8:1175-1179. PNNL-SA-139640. doi:10.1080/14786419.2018.1550759
Tsai C., R. Zhao, S.M. Williams, R.J. Moore, K.D. Schultz, W.B. Chrisler, and L. Pasa Tolic, et al. 2020. "An Improved Boosting to Amplify Signal with Isobaric Labeling (iBASIL) Strategy for Precise Quantitative Single-cell Proteomics." Molecular and Cellular Proteomics 19, no. 5:828-838. PNNL-SA-149183. doi:10.1074/mcp.RA119.001857
Colli M.L., M. Ramos-Rodriquez, E.S. Nakayasu, M.I. Alvelos, M. Lopes, J.L. Hill, and J. Turatsinze, et al. 2020. "An integrated multi-omics approach identifies the landscape of interferon-a-mediated responses of human pancreatic beta cells." Nature Communications 11, no. 1:Article No. 2584. PNNL-SA-144581. doi:10.1038/s41467-020-16327-0
Bagus P.S., C.J. Nelin, C.R. Brundle, N. Lahiri, E.S. Ilton, and K.M. Rosso. 2020. "Analysis of the Fe 2p XPS for Hematite alpha Fe2O3: Consequences of Covalent Bonding and Orbital Splittings on Multiplet Splittings." Journal of Chemical Physics 152, no. 1:014704. PNNL-SA-151329. doi:10.1063/1.5135595
Velivelli S.L., K. Czymmack, H. Li, J.B. Shaw, G.W. Buchko, and D. Shah. 2020. "Antifungal symbiotic peptide NCR044 exhibits unique structure and multifaceted mechanisms of action that confer plant protection." Proceedings of the National Academy of Sciences of the United States of America 117, no. 27:16043-16054. PNNL-SA-150641. doi:10.1073/pnas.2003526117
Luzi F., M.D. Fenn, J.F. Christ, Z.C. Kennedy, T. Varga, M.S. Hughes, and C.M. Ortiz Marrero. 2020. "Application of entropy and signal energy for ultrasound-based classification of three-dimensional printed polyetherketoneketone components." The Journal of the Acoustical Society of America 148, no. 1:292-301. PNNL-SA-151479. doi:10.1121/10.0001581
Liu Y., W. Peters, H. Hellmann, M. Knoblauch, J.E. Evans, D. Froelich, and s. mooney, et al. 2020. "Aspartate Residues in a Forisome-forming SEO Protein are Critical for Protein Body Assembly and Ca2+-Responsiveness." Plant and Cell Physiology. PNNL-SA-155876. doi:10.1093/pcp/pcaa093
Spurgeon S.R., T.C. Kaspar, V. Shutthanandan, J. Gigax, L. Shao, and M. Sassi. 2020. "Asymmetric Lattice Disorder Induced at Oxide Interfaces." Advanced Materials Interfaces 7, no. 8:Article No. 1901944. PNNL-SA-148989. doi:10.1002/admi.201901944
Zhao Y., H. Huang, Y. Zhang, K. Wu, F. Zeng, J. Wang, and X. Yu, et al. 2020. "Atmospheric Particulate Characterization by ToF-SIMS in an Urban Site in Beijing." Atmospheric Environment 220. PNNL-SA-148815. doi:10.1016/j.atmosenv.2019.117090
Xu Y., H. Wu, Y. He, Q. Chen, J. Zhang, W. Xu, and C. Wang. 2020. "Atomic to Nanoscale Origin of Vinylene Carbonate Enhanced Cycling Stability of Lithium Metal Anode Revealed by Cryo-Transmission Electron Microscopy." Nano Letters 20, no. 1:418-425. PNNL-SA-149594. doi:10.1021/acs.nanolett.9b04111
Nian Y., Z. Dong, S. Wang, Y. Wang, Y. Han, C. Wang, and L. Luo. 2020. "Atomic-Scale Dynamic Interaction of H2O Molecules with Cu Surface." Physical Review Letters 125, no. 15:156101. PNNL-SA-153693. doi:10.1103/PhysRevLett.125.156101
Williams S.M., A.V. Liyu, C. Tsai, R.J. Moore, D.J. Orton, W.B. Chrisler, and M.J. Gaffrey, et al. 2020. "Automated coupling of nanodroplet sample preparation with liquid chromatography-mass spectrometry for high-throughput single-cell proteomics." Analytical Chemistry 92, no. 15:10588â10596. PNNL-SA-152553. doi:10.1021/acs.analchem.0c01551
Piehowski P.D., Y. Zhu, L.M. Bramer, K.G. Stratton, R. Zhao, D.J. Orton, and R.J. Moore, et al. 2020. "Automated mass spectrometry imaging of over 2000 proteins from tissue sections at 100-Âµm spatial resolution." Nature Communications 11, no. 1:Article No. 8. PNNL-SA-138884. doi:10.1038/s41467-019-13858-z
Taga M., V.A. Petyuk, C. White, G. Marsh, Y. Ma, H. Klein, and S. Connor, et al. 2020. "BIN1 protein isoforms are differentially expressed in astrocytes, neurons, and microglia: neuronal and astrocyte BIN1 are implicated in tau pathology." Molecular Neurodegeneration 15, no. 1:44. PNNL-SA-156642.
Zeng Q., L. Huang, J. Ma, Z. Zhu, H. Chen, Q. Shi, and W. Liu, et al. 2020. "Bio-reduction of Ferrihydrite-montmorillonite-organic Matter Complexes: Effect of Montmorillonite and Fate of Organic Matter." Geochimica et Cosmochimica Acta 276. PNNL-SA-152385. doi:10.1016/j.gca.2020.03.011
Zhang T., M.J. Gaffrey, M.E. Monroe, D.G. Thomas, K.K. Weitz, P.D. Piehowski, and V.A. Petyuk, et al. 2020. "Block design with common reference samples enables robust large-scale label-free quantitative proteome profiling." Journal of Proteome Research 19, no. 7:2863â2872. PNNL-SA-151164. doi:10.1021/acs.jproteome.0c00310
Boiteau R.M., R.K. Kukkadapu, J.B. Cliff, C.R. Smallwood, L. Kovarik, M.G. Wirth, and M.H. Engelhard, et al. 2020. "Calcareous organic matter coatings sequester siderophores in alkaline soils." Science of the Total Environment 724. PNNL-SA-147851. doi:10.1016/j.scitotenv.2020.138250
Garayburu-Caruso V.A., J.C. Stegen, H. Song, L. Renteria, J.R. Wells, W.L. Garcia, and C.T. Resch, et al. 2020. "Carbon limitation leads to thermodynamic regulation of aerobic metabolism." Environmental Science & Technology Letters 7, no. 7:517-524. PNNL-SA-150146. doi:10.1021/acs.estlett.0c00258
O'Connell D., N. Ansems, R.K. Kukkadapu, D.P. Jaisi, D. Orihel, B. Cade-Menun, and Y. Hu, et al. 2020. "Changes in sedimentary phosphorus burial following artificial eutrophication of Lake 227, Experimental Lakes Area, Ontario, Canada." Journal of Geophysical Research. Biogeosciences 125, no. 8:Article No.e2020JG005713. PNNL-SA-151732. doi:10.1029/2020JG005713
Ogden A.J., W. Boukari, A. Nava, N. Lucinda, G. Sunter, W.R. Curtis, and J.N. Adkins, et al. 2020. "Characterization of Local and Systemic Impact of Whitefly (Bemisia tabaci) Feeding and Whitefly-Transmitted Tomato Mottle Virus Infection on Tomato Leaves by Comprehensive Proteomics." International Journal of Molecular Sciences 21, no. 19:7241. PNNL-SA-153927.
Zhou M., W. Liu, and J.B. Shaw. 2020. "Charge Movement and Structural Changes in the Gas-Phase Unfolding of Multimeric Protein Complexes Captured by Native Top-Down Mass Spectrometry." Analytical Chemistry 92, no. 2:1788-1795. PNNL-SA-145158. doi:10.1021/acs.analchem.9b03469
Gouaux E., J. Coleman, V. Navratna, D. Yang, J. Bull, and D. Antermite. 2020. "Chemical and structural investigation of the paroxetine-human serotonin transporter complex." eLife. doi:10.7554/eLife.56427
Sheng A., X. Li, Y. Arai, Y. Ding, K.M. Rosso, and J. Liu. 2020. "Citrate Controls Fe(II)-Catalyzed Transformation of Ferrihydrite by Complexation of the Labile Fe(III) Intermediate." Environmental Science & Technology 54, no. 12:7309â7319. PNNL-SA-151513. doi:10.1021/acs.est.0c00996
Daly P., M. Peng, H.D. Mitchell, Y. Kim, C.K. Ansong, H.M. Brewer, and P. De Gijsel, et al. 2020. "Colonies of the fungus Aspergillus niger are highly differentiated to adapt to local carbon source variation." Environmental Microbiology 22, no. 3:1154â1166. PNNL-SA-150305. doi:10.1111/1462-2920.14907
Krayev A.V., S. Krylyuk, R. Ilic, A. Hight Walker, A. Bhattarai, A.G. Joly, and M. Velicky, et al. 2020. "Comparable Enhancement of TERS Signals from WSe2 on Chromium and Gold." Journal of Physical Chemistry C 124, no. 16:8971-8977. PNNL-SA-140248. doi:10.1021/acs.jpcc.0c01298
Bone S.E., J.B. Cliff, K. Weaver, C.J. Takacs, S.J. Roycroft, S. Fendorf, and J.R. Bargar, et al. 2020. "Complexation by Organic Matter Controls Uranium Mobility in Anoxic Sediments." Environmental Science & Technology 54, no. 3:1493-1502. PNNL-SA-142857. doi:10.1021/acs.est.9b04741
Eguchi A., R. Yan, S. Pan, R. Wu, J. Kim, Y. Chen, and C.K. Ansong, et al. 2020. "Comprehensive characterization of hepatocyte-derived extracellular vesicles identifies direct miRNA-based regulation of hepatic stellate cells and DAMP-based hepatic macrophage IL-1Ã and IL-17 upregulation in alcoholic hepatitis mice." Journal of Molecular Medicine. PNNL-SA-155939. doi:10.1007/s00109-020-01926-7
Nakayasu E.S., F. Syed, S. Tersey, M.A. Gritsenko, H.D. Mitchell, C. Chan, and J. Turatsinze, et al. 2020. "Comprehensive proteomics analysis of stressed human islets identifies GDF15 as a target for type 1 diabetes intervention." Cell Metabolism 31, no. 2:363-374.e6. PNNL-SA-150166. doi:10.1016/j.cmet.2019.12.005
Flores J., S.L. Reichow, J. Myers, C. Yoshioka, B. Haddad, J. Copperman, and D. Zuckerman. 2020. "Connexin-46/50 in a dynamic lipid environment resolved by CryoEM at 1.9?Ã." Nature Communications. doi:10.1038/s41467-020-18120-5
Tao J., M. Lee, M.L. Sushko, J.J. De Yoreo, J. Liu, Z. Zhang, and D. Banerjee, et al. 2020. "Controlling MetalâOrganic Framework/ZnO heterostructure kinetics through selective ligand binding to ZnO surface steps." Chemistry of Materials 32, no. 15:6666â6675. PNNL-SA-153263. doi:10.1021/acs.chemmater.0c02123
Song J., K. Wang, J. Zheng, M.H. Engelhard, B. Xiao, E. Hu, and Z. Zhu, et al. 2020. "Controlling Surface Phase Transition and Chemical Reactivity of O3-Layered Metal Oxide Cathodes for High-Performance Na-ion Batteries." ACS Energy Letters 5, no. 6:1718-1725. PNNL-SA-141318. doi:10.1021/acsenergylett.0c00700
Shaw W.J., B.J. Tarasevich, G.W. Buchko, R.M. Jayasinha Arachchige, and S.D. Burton. 2020. "Controls of Nature: Secondary, tertiary, and quaternary structure of the enamel protein amelogenin in solution and on hydroxyapatite." Journal of Structural Biology 212, no. 3:Article No. 107630. PNNL-SA-153314. doi:10.1016/j.jsb.2020.107630
Krzysko A., E. Nakouzi, X. Zhang, T.R. Graham, K.M. Rosso, G.K. Schenter, and J. Ilavsky, et al. 2020. "Correlating inter-particle forces and particle shape to shear-induced aggregation/fragmentation and rheology for dilute anisotropic particle suspensions: a complementary study via capillary rheometry and in situ small and ultra-small angle X-ray scattering." Journal of Colloid and Interface Science 576. PNNL-SA-148317. doi:10.1016/j.jcis.2020.04.016
Liu W., L. Huang, R.E. Komorek, P. Handakumbura, Y. Zhou, D. Hu, and M.H. Engelhard, et al. 2020. "Correlative Surface Imaging Reveals Chemical Signatures for Bacterial Hotspots on Plant Roots." Analyst 145, no. 2:393-401. PNNL-SA-149225. doi:10.1039/C9AN01954E
Placencia-Gomez R.E., S.N. Kerisit, H.S. Mehta, O. Qafoku, C.J. Thompson, T.R. Graham, and E.S. Ilton, et al. 2020. "Critical Water Coverage during Forsterite Carbonation in Thin Water Films: Activating Dissolution and Mass Transport." Environmental Science & Technology 54, no. 11:6888â6899. PNNL-SA-151291. doi:10.1021/acs.est.0c00897
Li T., D.E. Perea, D.K. Schreiber, M.G. Wirth, G.J. Orren, and G.S. Frankel. 2020. "Cryo-based Structural Characterization and Growth Model of Salt Film on Metal." Corrosion Science 174. PNNL-SA-152669. doi:10.1016/j.corsci.2020.108812
Sobti M., J.L. Walshe, D. Wu, R. Ishmukhametov, Y.C. Zeng, C.V. Robinson, and R.M. Berry, et al. 2020. "Cryo-EM Structures Provide Insight Into How E. coli F1Fo ATP Synthase Accommodates Symmetry Mismatch." Nature Communications 11. doi:10.1038/s41467-020-16387-2
Yuan Q., W. Cao, and X. Wang. 2020. "Cryogenic and Temperature-Dependent Photoelectron Spectroscopy of Metal Complexes." International Reviews in Physical Chemistry 39, no. 1:83-108. PNNL-SA-149791. doi:10.1080/0144235X.2020.1719699
Zhang H., W. Cao, Q. Yuan, X. Zhou, M. Valiev, S.R. Kass, and X. Wang. 2020. "Cryogenic âIodide-Taggingâ Photoelectron Spectroscopy: A Sensitive Probe for Specific Binding Sites of Amino Acids." Journal of Physical Chemistry Letters 11, no. 11:4346â4352. PNNL-SA-152646. doi:10.1021/acs.jpclett.0c01099
Mallesham B., S. Roy, S. Bose, A.N. Nair, S. Sreenivasan, V. Shutthanandan, and C. Ramana. 2020. "Crystal Chemistry, Band-Gap Red Shift and Electrocatalytic Activity of Iron-Doped Gallium Oxide Ceramics." ACS Omega 5, no. 1:104-112. PNNL-SA-141643. doi:10.1021/acsomega.9b01604
Ma Z., J. Abendroth, G.W. Buchko, K.H. Rohde, and V.L. Davidson. 2020. "Crystal structure of a hemerythrin-like protein from Mycobacterium kansasii and homology model of the orthologous Rv2633c protein of M. tuberculosis." Biochemical Journal 477, no. 2:567-581. PNNL-SA-147766. doi:10.1042/BCJ20190827
Xu Y., H. Wu, H. Jia, J. Zhang, X. Wu, and C. Wang. 2020. "Current density regulated atomic to nanoscale process on Li deposition and solid electrolyte interphase revealed by Cryogenic Transmission Electron Microscopy." ACS Nano 14, no. 7:8766-8775. PNNL-SA-152803. doi:10.1021/acsnano.0c03344
Luo L., L. Li, D.K. Schreiber, Y. He, D.R. Baer, S.M. Bruemmer, and C. Wang. 2020. "Deciphering atomistic mechanisms of the gas-solid interfacial reaction during alloy oxidation." Science Advances 6, no. 7:Article No. eaay8491. PNNL-SA-147915. doi:10.1126/sciadv.aay8491
Colby S.M., J. Nunez, N.O. Hodas, C.D. Corley, and R.S. Renslow. 2020. "Deep learning to generate in silico chemical property libraries and candidate molecules for small molecule identification in complex samples." Analytical Chemistry 92, no. 2:1720-1729. PNNL-SA-144150. doi:10.1021/acs.analchem.9b02348
Lee M., K. Han, J. Lee, Y. Shin, T.C. Kaspar, Y. Chen, and M.H. Engelhard, et al. 2020. "Defect-induced anisotropic surface reactivity and ion transfer procresses of anatase nanparticles." Materials Today Chemistry 17. PNNL-SA-150217. doi:10.1016/j.mtchem.2020.100290
Zhang G., J. Zhang, R. Dehoog, M. Darshi, S. Pennathur, C.R. Anderton, and M.A. Venkatachalam, et al. 2020. "DESI-MSI Based Spatial Metabolomics and METASPACE Indicates RNA and Mitochondrial Dysfunction in Renal Proximal Tubules of Mice with Diabetes Running Title: MS Imaging in DKD." Metabolomics. PNNL-SA-132461. doi:10.1007/s11306-020-1637-8
Lee J., T. Shi, V.A. Petyuk, A.A. Schepmoes, T.L. Fillmore, Y. Wang, and W.A. Cardoni, et al. 2020. "Detection of head and neck cancer based on longitudinal changes in serum protein abundance." Cancer Epidemiology, Biomarkers and Prevention 29, no. 8:1665-1672. PNNL-ACT-SA-10471. doi:10.1158/1055-9965.EPI-20-0192
Zhang J., Y. Yang, Z. Sun, and X. Wang. 2020. "Determinants for proton location and electron coupled proton transfer in hydrogen bonded pentafluorophenol-anion clusters." Physical Chemistry Chemical Physics. PCCP 22, no. 29:16712-16720. PNNL-SA-153757. doi:10.1039/D0CP02892D
Jiang W., T. Wang, Y. Wang, Z. Zhu, L. Shao, and D.J. Senor. 2020. "Deuterium diffusion in gamma-LiAlO2 pellets irradiated with He+ and D2+ ions." Journal of Nuclear Materials 538. PNNL-SA-150710. doi:10.1016/j.jnucmat.2020.152357
Shaw J.B., W. Liu, Y.V. Vasil'Ev, C.C. Bracken, N. Malhan, A.L. Guthals, and J.S. Beckman, et al. 2020. "Direct Determination of Antibody Chain Pairing by Top-down and Middle-down Mass Spectrometry using Electron Capture Dissociation and Ultraviolet Photodissociation." Analytical Chemistry 92, no. 1:766-773. PNNL-SA-145157. doi:10.1021/acs.analchem.9b03129
Warneke J., M. Mayer, M. Rohdenburg, X. Ma, J.K. Liu, V.A. Azov, and E. Apra, et al. 2020. "Direct functionalization of C-H bonds by electrophilic anions." Proceedings of the National Academy of Sciences of the United States of America 117, no. 38:23374-23379. PNNL-SA-149918. doi:10.1073/pnas.2004432117
Yalcin S., B.A. Legg, M. Yesilbas, N.S. Malvankar, and J. Boily. 2020. "Direct Observation of Anisotropic Growth of Water Films on Minerals Driven by Defects and Surface Tension." Science Advances 6, no. 30:eaaz9708. doi:10.1126/sciadv.aaz9708
He Y., B. Li, C. Wang, and S.X. Mao. 2020. "Direct Observation of Dual-Step Twinning Nucleation in Hexagonal Close-Packed Crystals." Nature Communications 11, no. 1:2483. PNNL-SA-152795. doi:10.1038/s41467-020-16351-0
Elnaas A.R., D. Grice, J. Han, Y. Feng, A. Di Capau, T. Mak, and J.A. Laureanti, et al. 2020. "Discovery of a Natural Product that Binds to the Mycobacterium tuberculosis Protein Rv1466 by Native Mass Spectrometry." Molecules 25, no. 10:2384. PNNL-SA-152797. doi:10.3390/molecules25102384
Ji M., W. Kong, J.C. Stegen, L. Yue, F. Wang, X. Dong, and D.A. Cowan, et al. 2020. "Distinct assembly mechanisms underlie similar biogeographical patterns of rare and abundant bacteria in Tibetan Plateau grassland soils." Environmental Microbiology 22, no. 6:2261â2272. PNNL-SA-140351. doi:10.1111/1462-2920.14993
Nelson W.C., E.B. Graham, A.R. Crump, S.J. Fansler, E.V. Arntzen, D.W. Kennedy, and J.C. Stegen. 2020. "Distinct temporal diversity profiles for nitrogen cycling genes in a hyporheic microbiome." PLoS One 15, no. 1:Article No. e0228165. PNNL-SA-125632. doi:10.1371/journal.pone.0228165
Qin Z., G. Hou, Z. Yang, M. Valiev, and X. Wang. 2020. "Distonic radical anion species in cysteine oxidation processes." Physical Chemistry Chemical Physics. PCCP 22, no. 31:17554-17558. PNNL-SA-152315. doi:10.1039/D0CP02165B
Hollingsworth L.R., H. Sharif, A.R. Griswold, P. Fontana, J. Mintseris, K.A. Dagbay, and J.A. Paulo, et al. 2020. "DPP9 Directly Sequesters the NLRP1 C-terminus to Repress Inflammasome Activation." bioRxiv preprint.
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2018

Hu J.Z., N. Rajput, C. Wan, Y. Shao, X. Deng, N.R. Jaegers, and M.Y. Hu, et al. 2018. "25Mg NMR and Computational Modeling Studies of the Solvation Structures and Molecular Dynamics in Magnesium Based Liquid Electrolytes." Nano Energy 46. PNNL-SA-130126. doi:10.1016/j.nanoen.2018.01.051
Graham T.R., K. Han, M. Dembowski, A. Krzysko, X. Zhang, J.Z. Hu, and S.B. Clark, et al. 2018. "27Al Pulsed Field Gradient, Diffusion-NMR Spectroscopy of Solvation Dynamics and Ion Pairing in Alkaline Aluminate Solutions." Journal of Physical Chemistry B 122, no. 48:10907-10912. PNNL-SA-138291. doi:10.1021/acs.jpcb.8b10145
Orton D.J., M.M. Tfaily, R.J. Moore, B.L. Lamarche, X. Zheng, T.L. Fillmore, and R.K. Chu, et al. 2018. "A Customizable Flow Injection System for Automated, High Throughput and Time Sensitive Ion Mobility Spectrometry and Mass Spectrometry Measurements." Analytical Chemistry 90, no. 1:737-744. PNNL-SA-128111. doi:10.1021/acs.analchem.7b02986
Mirts E.N., I.D. Petrik, P. Hosseinzadeh, M.J. Nilges, and Y. Lu. 2018. "A designed heme-[4Fe-4S] metalloenzyme catalyzes sulfite reduction like the native enzyme." Science 361, no. 6407:1098-1101. PNNL-SA-138512. doi:10.1126/science.aat8474
Xu L., E.E. Stangland, and M. Mavrikakis. 2018. "A DFT Study of Chlorine Coverage Over Late Transition Metals and its Implication on 1,2-dichloroethane Hydrodechlorination." Catalysis Science & Technology. doi:10.1039/C7CY02647A
Corbin C., S. Drouet, L. Markulin, D. Auguin, D. Auguin, E. Laine, and L.B. Davin, et al. 2018. "A genome-wide analysis of the flax (Linum usitatissimum L.) dirigent protein family: from gene identification and evolution to differential regulation." Plant Molecular Biology 97, no. 1-2:73-101. PNNL-SA-131411. doi:10.1007/s11103-018-0725-x
Ortega C., A. Frando, B.M. Webb-Robertson, L.N. Anderson, N. Fleck, E.L. Flannery, and M. Fishbaugher, et al. 2018. "A global survey of ATPase activity in Plasmodium falciparum asexual blood stages and gametocytes." Molecular and Cellular Proteomics 17, no. 1:111-120. PNNL-SA-121236. doi:10.1074/mcp.RA117.000088
Prabhakaran Nair Syamala Amma A., A.M. Hamid, V. Garimella, B.R. Valenzuela, R.G. Ewing, Y.M. Ibrahim, and R.D. Smith. 2018. "A Hybrid Constant and Oscillatory Field Ion Mobility Analyzer in Structures for Lossless Ion Manipulations." Journal of the American Society for Mass Spectrometry 29, no. 2:342-351. PNNL-SA-126448. doi:10.1007/s13361-017-1841-6
Yu L., S. Chen, H. Lee, L. Zhang, M.H. Engelhard, Q. Li, and S. Jiao, et al. 2018. "A Localized High-Concentration Electrolyte with Optimized Solvents and Lithium Difluoro(oxalate)borate Additive for Stable Lithium Metal Batteries." ACS Energy Letters 3, no. 9:2059-2067. PNNL-SA-134778. doi:10.1021/acsenergylett.8b00935
Schreiber D.K., D.E. Perea, J.V. Ryan, J.E. Evans, and J.D. Vienna. 2018. "A method for site-specific and cryogenic specimen fabrication of liquid/solid interfaces for atom probe tomography." Ultramicroscopy 194. PNNL-SA-133479. doi:10.1016/j.ultramic.2018.07.010
Cardon Z.G., E. Peredo, A. Dohnalkova, G. Hannah, and M. Bazanilla. 2018. "A model suite of green algae within the Scenedesmaceae for investigating contrasting desiccation tolerance and morphology." Journal of Cell Science 131, no. 7:Article No. jcs212233. PNNL-SA-133995. doi:10.1242/jcs.212233
Yan Z., B. Bond-Lamberty, K. Todd-Brown, V.L. Bailey, S. Li, C. Liu, and C. Liu. 2018. "A moisture function of soil heterotrophic respiration that incorporates microscale processes." Nature Communications 9, no. 1:Article No. 2562. PNNL-SA-126718. doi:10.1038/s41467-018-04971-6
Chatterjee S., B. Singh, A. Diwan, Z. Lee, M.H. Engelhard, J.H. Terry, and D. Tolley, et al. 2018. "A Perspective on Two Chemometrics Tools: PCA and MCR, and Introduction of a New One: Pattern Recognition Entropy (PRE), as Applied to XPS and ToF-SIMS Depth Profiles of Organic and Inorganic Materials." Applied Surface Science 433. PNNL-SA-126002. doi:10.1016/j.apsusc.2017.09.210
Jin Q., B. Chen, Z. Ren, X. Liang, N. Liu, and D. Mei. 2018. "A Theoretical Study on Reaction Mechanisms and Kinetics of Thiophene Hydrodesulfurization over MoS2 Catalysts." Catalysis Today 312. PNNL-SA-130462. doi:10.1016/j.cattod.2018.02.013
Rai D., A. Kitamura, M.J. Altmaier, K.M. Rosso, T. Sasaki, and T. Kobayashi. 2018. "A Thermodynamic Model for ZrO2(am) Solubility at 25Â°C in the Ca2+-Na+-H+- Cl-- OH--H2O System: A Critical Review." Journal of Solution Chemistry 47, no. 5:855-891. PNNL-SA-133220. doi:10.1007/s10953-018-0766-4
Olah M., E. Patrick, A. Villani, J. Xu, C. White, K. Ryan, and P.D. Piehowski, et al. 2018. "A transcriptomic atlas of aged human microglia." Nature Communications 9, no. 1:Article No. 539. PNNL-SA-134273. doi:10.1038/s41467-018-02926-5
Shah D., D.I. Patel, T. Roychowdhury, G.B. Rayner, N. O'Toole, D.R. Baer, and M.R. Linford. 2018. "A Tutorial on Interpreting X-ray Photoelectron Spectroscopy (XPS) Survey." Journal of Vacuum Science and Technology B--Microelectronics and Nanometer Structures 36, no. 6:062902. PNNL-SA-138872. doi:10.1116/1.5043297
Huang J., Z. Yang, V. Murugesan, W. Duan, A.M. Hollas, B. Pan, and W. Wang, et al. 2018. "A Two-Electron Nonaqueous Organic Redox Flow Battery." Advanced Sustainable Systems 2, no. 3:1700131. PNNL-SA-128375. doi:10.1002/adsu.201700131
Zhang X., Y. He, J. Liu, M.E. Bowden, L. Kovarik, S.X. Mao, and C. Wang, et al. 2018. "Accessing crystal-crystal interaction forces with oriented nanocrystal atomic force microscopy probes." Nature Protocols 13, no. 9:2005-2030. PNNL-SA-131668. doi:10.1038/s41596-018-0027-4
Khivantsev K., N.R. Jaegers, L. Kovarik, J.c. Hanson, F. Tao, Y. Tang, and X. Zhang, et al. 2018. "Achieving Atomic Dispersion of Highly Loaded Transition Metals in Small-pore Zeolite SSZ-13: High-capacity and High-efficiency Low Temperature CO and Passive NOx Adsorbers." Angewandte Chemie International Edition 57, no. 51:16672-16677. PNNL-SA-136340. doi:10.1002/anie.201809343
Gittus O., G. Von Rudorff, K.M. Rosso, and J. Blumberger. 2018. "Acidity Constants of the Hematite-Liquid Water Interface from Ab Initio Molecular Dynamics." Journal of Physical Chemistry Letters 9, no. 18:5574-5582. PNNL-SA-140520. doi:10.1021/acs.jpclett.8b01870
Suski K.J., D.M. Bell, N. Hiranuma, O. Mohler, D. Imre, and A. Zelenyuk-Imre. 2018. "Activation of Intact Bacteria and Bacterial Fragments Mixed with Agar as Cloud Droplets and Ice Crystals in Cloud CHamber Experiments." Atmospheric Chemistry and Physics 18, no. 23:17497-17513. PNNL-SA-131706. doi:10.5194/acp-18-17497-2018
Pan H., K. Han, M.H. Engelhard, R. Cao, J. Chen, J. Zhang, and K.T. Mueller, et al. 2018. "Addressing Passivation in LithiumâSulfur Battery under Lean-Electrolyte Condition." Advanced Functional Materials 28, no. 38:Article Number 1707234. PNNL-SA-131237. doi:10.1002/adfm.201707234
Callister S.J., T.L. Fillmore, C.D. Nicora, J.B. Shaw, S.O. Purvine, D.J. Orton, and R.A. White, et al. 2018. "Addressing the challenge of soil metaproteome complexity by improving metaproteome depth of coverage Through two-dimensional liquid chromatography." Soil Biology and Biochemistry 125. PNNL-SA-131999. doi:10.1016/j.soilbio.2018.07.018
Cui W., P. Li, Z. Wang, S. Zheng, and Y. Zhang. 2018. "Adsorption study of selenium ions from aqueous solutions using MgO nanosheets synthesized by ultrasonic method." Journal of Hazardous Materials 341. PNNL-SA-128498. doi:10.1016/j.jhazmat.2017.07.073
Wilson R.M., and M.M. Tfaily. 2018. "Advanced Molecular Techniques Provide New Rigorous Tools for Characterizing Organic Matter Quality in Complex Systems." Journal of Geophysical Research. Biogeosciences 123, no. 6:1790â1795. PNNL-SA-135802. doi:10.1029/2018JG004525
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May N.W., N. Olson, M.H. Panas, J.L. Axson, P.N. Tirella, R.M. Kirpes, and R.L. Craig, et al. 2018. "Aerosol Emissions from Great Lakes Harmful Algal Blooms." Environmental Science & Technology 52, no. 2:397-405. PNNL-SA-129527. doi:10.1021/acs.est.7b03609
Smith J.N., D.G. Thomas, H.D. Jolley, V.K. Kodali, M.H. Littke, P. Munusamy, and D.R. Baer, et al. 2018. "All that is Silver is not Toxic: Silver Ion and Particle Kinetics Reveals the Role of Silver Ion Aging and Dosimetry on the Toxicity of Silver Nanoparticles." Particle and Fibre Toxicology 15. PNNL-SA-135829. doi:10.1186/s12989-018-0283-z
Bilbao Pena A., B.C. Gibbons, G.W. Slysz, K.L. Crowell, M.E. Monroe, Y.M. Ibrahim, and R.D. Smith, et al. 2018. "An Algorithm to Correct Saturated Mass Spectrometry Ion Abundances for Enhanced Quantitation and Mass Accuracy in Omic Studies." International Journal of Mass Spectrometry 427. PNNL-SA-126312. doi:10.1016/j.ijms.2017.11.003
Therrien A.J., A.J. Hensley, M.D. Marcinkowski, R. Zhang, F.R. Lucci, B. Coughlin, and A.C. Schilling, et al. 2018. "An atomic-scale view of single-site Pt catalysis for low-temperature CO oxidation." Nature Catalysis 1, no. 3:192â198. PNNL-SA-135489. doi:10.1038/s41929-018-0028-2
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Kedia K., J.P. Wendler, E.M. Baker, K.E. Burnum-Johnson, L.G. Jarsberg, K.G. Stratton, and A.T. Wright, et al. 2018. "Application of multiplexed ion mobility spectrometry towards the identification of host protein signatures of treatment effect in pulmonary tuberculosis." Tuberculosis 112. PNNL-SA-137966. doi:10.1016/j.tube.2018.07.005
Cai Q., J.A. Lopez-Ruiz, A.R. Cooper, J. Wang, K.O. Albrecht, and D. Mei. 2018. "Aqueous-Phase Acetic Acid Ketonization over Monoclinic Zirconia." ACS Catalysis 8, no. 1:488-502. PNNL-SA-112607. doi:10.1021/acscatal.7b03298
Spindel J., J.A. Dahlberg, M. Colgan, J. Hollingsworth, J. Sievert, S. Staggenborg, and B. Hutmacher, et al. 2018. "Association mapping by aerial drone reveals 213 genetic associations for Sorghum bicolor biomass traits under drought." BMC Genomics 19. PNNL-SA-131382. doi:10.1186/s12864-018-5055-5
Exertier F., A. La Fontaine, C. Corcoran, S. Piazolo, E. Belousova, Z. Peng, and B. Gault, et al. 2018. "Atom probe tomography analysis of the reference Zircon GJ-1: An interlaboratory study." Chemical Geology 495. PNNL-SA-130160. doi:10.1016/j.chemgeo.2018.07.031
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Zhang X., P.I. Huestis, C.I. Pearce, J.Z. Hu, K. Page, L.M. Anovitz, and A. Aleksandrov, et al. 2018. "Boehmite and Gibbsite Nanoplates for the Synthesis of Advanced Alumina Products." ACS Applied Nano Materials 1, no. 12:7115-7128. PNNL-SA-139693. doi:10.1021/acsanm.8b01969
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Zhou M., J. Yan, C.A. Romano, B.M. Tebo, V.H. Wysocki, and L. Pasa Tolic. 2018. "Surface Induced Dissociation Coupled with High Resolution Mass Spectrometry Unveils Heterogeneity of a 211 kDa Multicopper Oxidase Protein Complex." Journal of the American Society for Mass Spectrometry 29, no. 4:723-733. PNNL-SA-124854. doi:10.1007/s13361-017-1882-x
Joly A.G., Y. Gong, P.Z. El-Khoury, and W.P. Hess. 2018. "Surface Plasmon-Based Pulse Splitter and Polarization Multiplexer." Journal of Physical Chemistry Letters 9, no. 21:6164-6168. PNNL-SA-137832. doi:10.1021/acs.jpclett.8b02643
Sutherland-Harper S., R. Taylor, J. Hobbs, S. Pimblott, R. Pattrick, M. Sarsfield, and M.A. Denecke, et al. 2018. "Surface speciation and interactions between adsorbed chloride and water on cerium dioxide." Journal of Solid State Chemistry 262. PNNL-SA-128945. doi:10.1016/j.jssc.2018.02.018
Chatterjee S., G.B. Hall, I. Johnson, Y. Du, E.D. Walter, N.M. Washton, and T.G. Levitskaia. 2018. "Surprising formation of quasi-stable Tc(VI) in high ionic strength alkaline media." Inorganic Chemistry Frontiers 5, no. 9:2081-2091. PNNL-SA-130004. doi:10.1039/C8QI00219C
Wustrow A.E., B. Key, P.J. Phillips, N. Sa, A.S. Lipton, R.F. Klie, and J. Vaughey, et al. 2018. "Synthesis and Characterization of MgCr2S4 Thiospinel as a Potential Magnesium Cathode." Inorganic Chemistry 57, no. 14:8634â8638. PNNL-SA-135174. doi:10.1021/acs.inorgchem.8b01417
Wustrow A.E., B. Key, P.J. Phillips, N. Sa, A.S. Lipton, R.F. Klie, and J. Vaughey, et al. 2018. "Synthesis and Characterization of MgCr2S4 Thiospinel as a Potential Magnesium Cathode." Inorganic Chemistry 2018, no. 57:8634-8638. PNNL-SA-147559. doi:10.1021/acs.inorgchem.8b01417
Self E.C., L. Zou, M. Zhang, R. Opfer, R. Ruther, G.M. Veith, and B. Song, et al. 2018. "Synthesis and Electrochemical and Structural Investigations of Oxidatively Stable Li2MoO3 and xLi2MoO3Â·(1 - x)LiMO2 Composite Cathodes." Chemistry of Materials 30. PNNL-SA-138456. doi:10.1021/acs.chemmater.8b01408
Qafoku O., E.S. Ilton, M.E. Bowden, L. Kovarik, X. Zhang, R.K. Kukkadapu, and M.H. Engelhard, et al. 2018. "Synthesis of Nanometer-Sized Fayalite and Magnesium-Iron(II) Mixture Olivines." Journal of Colloid and Interface Science 515. PNNL-SA-131663. doi:10.1016/j.jcis.2018.01.036
Yan P., J. Zheng, J. Liu, B. Wang, X. Sun, C. Wang, and J. Zhang. 2018. "Tailoring grain boundary structures and chemistry of Ni-rich layered cathodes for enhanced cycle stability of lithium-ion batteries." Nature Energy 3, no. 7:600-605. PNNL-SA-130003. doi:10.1038/s41560-018-0191-3
Yu L., V.A. Petyuk, C. Gaiteri, S. Mostafavi, T. Young-Pearse, R.C. Shah, and A. Buchman, et al. 2018. "Targeted Brain Proteomics Uncover Multiple Pathways to Alzheimerâs Dementia." Annals of Neurology 84, no. 1:78-88. PNNL-SA-136156. doi:10.1002/ana.25266
Yi L., T. Shi, M.A. Gritsenko, C. Chan, T.L. Fillmore, B.M. Hess, and A.C. Swensen, et al. 2018. "Targeted Quantification of Phosphorylation Dynamics in the Context of EGFR-MAPK Pathway." Analytical Chemistry 90, no. 8:5256-5263. PNNL-SA-131519. doi:10.1021/acs.analchem.8b00071
Luque-Ceballos J.C., L. Sementa, E. Apra, A. Fortunelli, and A. Posada-Amarillas. 2018. "TDDFT Study of the Optical Spectra of Free and Supported Binary Coinage Metal Hexamers: Effect of Doping and Support." Journal of Physical Chemistry C 122, no. 40:23143â23152. PNNL-SA-137797. doi:10.1021/acs.jpcc.8b06397
Lawter A.R., W.L. Garcia, R.K. Kukkadapu, O. Qafoku, M.E. Bowden, S.A. Saslow, and N. Qafoku. 2018. "Technetium and iodine aqueous species immobilization and transformations in the presence of strong reductants and calcite-forming solutions: Remedial action implications." Science of the Total Environment 636. PNNL-SA-129751. doi:10.1016/j.scitotenv.2018.04.240
Kruska K., D.K. Schreiber, M.J. Olszta, B.J. Riley, and S.M. Bruemmer. 2018. "Temperature-dependent selective oxidation processes for Ni-5Cr and Ni-4Al." Corrosion Science 139. PNNL-SA-129585. doi:10.1016/j.corsci.2018.04.037
Roy Chowdhury T., L.M. Bramer, D.W. Hoyt, Y. Kim, T.O. Metz, L. McCue, and H.L. Diefenderfer, et al. 2018. "Temporal dynamics of CO2 and CH4 loss potentials in response to rapid hydrological shifts in tidal freshwater wetland soils." Ecological Engineering 114. PNNL-SA-123359. doi:10.1016/j.ecoleng.2017.06.041
Wanzek T., M. Keiluweit, T. Varga, A. Lindsley, P.S. Nico, S. Fendorf, and M. Kleber. 2018. "The Ability of Soil Pore Network Metrics to Predict Redox Dynamics Is Scale Dependent." Soil Systems 2, no. 66:1-25. PNNL-SA-141472. doi:10.3390/soilsystems2040066
Baer D.R. 2018. "The Chameleon Effect: characterization challenges due to the variability of nanoparticles and their surfaces." Frontiers in Chemistry 6. PNNL-SA-131780. doi:10.3389/fchem.2018.00145
Bondy A.L., D. Bonanno, R.C. Moffet, B. Wang, A. Laskin, and A.P. Ault. 2018. "The diverse chemical mixing state of aerosol particles in the southeastern United States." Atmospheric Chemistry and Physics 18, no. 16:12595-12612. PNNL-SA-138963. doi:10.5194/acp-18-12595-2018
Bach E., G. Narvaez-Rivera, K.E. Murray, J.T. Bauer, and K.S. Hofmockel. 2018. "The dynamic life of arbuscular mycorrhizal fungal symbionts." Ecology 99, no. 4:978-980. PNNL-SA-129609. doi:10.1002/ecy.2096
Popel A., T.W. Wietsma, M.H. Engelhard, A. Lea, O. Qafoku, C. Grygiel, and I. Monnet, et al. 2018. "The Effect of Ion Irradiation on the Dissolution of UO2 and UO2-based Simulant Fuel." Journal of Alloys and Compounds 735. PNNL-SA-129551. doi:10.1016/j.jallcom.2017.11.216
Mishra K., W. Xu, M.H. Engelhard, R. Cao, J. Xiao, J. Zhang, and X. Zhou. 2018. "The effect of solvent on the capacity retention in a germanium anode for lithium ion batteries." Journal of Electrochemical Energy Conversion and Storage 15, no. 4:041012. PNNL-SA-122448. doi:10.1115/1.4039860
Petyuk V.A., R.R. Chang, M. Ramirez Restrepo, N.B. Bechmann, M.Y. Henrion, P.D. Piehowski, and K. Zhu, et al. 2018. "The human brainome: network analysis identifies HSPA2 as a novel Alzheimer’s disease target." Brain 141, no. 9:2721â2739. PNNL-SA-133886. doi:10.1093/brain/awy215
Kajimoto M., M. Nuri, N.G. Isern, I. Robillard Frayne, C. Des Rosiers, and M.A. Portman. 2018. "The Metabolic Response of the Immature Right Ventricle to Acute Pressure Overloading." Journal of the American Heart Association 7, no. 11:Article No. e008570. PNNL-SA-128316. doi:10.1161/JAHA.118.008570
Nicora C.D., K.E. Burnum-Johnson, E.S. Nakayasu, C.P. Casey, R.A. White, T. Roy Chowdhury, and J.E. Kyle, et al. 2018. "The MPLEx Protocol for Multi-Omic Analyses of Soil Samples." Journal of Visualized Experiments e57343, no. 135. PNNL-SA-129344. doi:10.3791/57343
Reynolds L.L., K. Lajtha, R.D. Bowden, M.M. Tfaily, B.R. Johnson, and S.D. Bridgham. 2018. "The path from litter to soil: Insights into soil C cycling from long-term input-manipulation and high-resolution mass spectrometry." Journal of Geophysical Research. Biogeosciences 123, no. 5:1486-1497. PNNL-SA-121067. doi:10.1002/2017JG004076
Ling F.T., J.E. Post, P.J. Heaney, and E.S. Ilton. 2018. "The relationship between Mn oxidation state and structure in triclinic and hexagonal birnessites." Chemical Geology 479. PNNL-SA-135583. doi:10.1016/j.chemgeo.2018.01.011
Notini L., D. Latta, A. Neumann, C.I. Pearce, M. Sassi, A.T. N'Diaye, and K.M. Rosso, et al. 2018. "The role of defects in Fe(II) â goethite electron transfer." Environmental Science & Technology 52, no. 5:2751-2759. PNNL-SA-131667. doi:10.1021/acs.est.7b05772
Moser T.H., H.S. Mehta, C. Park, R.T. Kelly, T. Shokuhfar, and J.E. Evans. 2018. "The role of electron irradiation history in liquid cell transmission electron microscopy." Science Advances 4, no. 4:eaaq1202. PNNL-SA-120688. doi:10.1126/sciadv.aaq1202
Tacey S.A., T. Szilvasi, L. Xu, J.J. Schauer, and M. Mavrikakis. 2018. "The Role of Iron-oxide Aerosols and Sunlight in the Atmospheric Reduction of Hg(II) Species: A DFT+U Study." Applied Catalysis B: Environmental 234. doi:10.1016/j.apcatb.2018.04.049
Oleksak R.P., M. Kapoor, D.E. Perea, G.R. Holcomb, and O.N. Dogan. 2018. "The role of metal vacancies during high-temperature oxidation of alloys." npj Materials Degradation. PNNL-SA-133339. doi:10.1038/s41529-018-0046-1
Nanda R., U. Reddy, G.M. Bowers, M.E. Bowden, and R.J. Kirkpatrick. 2018. "The Structural and Dynamical Role of Water in Natural Organic Matter: A H-2 NMR and XRD Study." Organic Geochemistry 123. PNNL-SA-131438. doi:10.1016/j.orggeochem.2018.06.011
Ren Z., N. Liu, B. Chen, J. Li, and D. Mei. 2018. "Theoretical Investigation of the Structural Stabilities of Ceria Surfaces and Supported Metal Nanocluster in Vapor and Aqueous Phases." Journal of Physical Chemistry C 122, no. 9:4828-4840. PNNL-SA-129903. doi:10.1021/acs.jpcc.7b10208
Devaraj A., D.E. Perea, J. Liu, L.M. Gordon, T.J. Prosa, P.A. Parikh, and D.R. Diercks, et al. 2018. "Three-dimensional nanoscale characterisation of materials by atom probe tomography." International Materials Reviews 63, no. 2:68-101. PNNL-SA-117399. doi:10.1080/09506608.2016.1270728
Apra E., A. Bhattarai, K.T. Crampton, E.J. Bylaska, N. Govind, W.P. Hess, and P.Z. El-Khoury. 2018. "Time Domain Simulations of Single Molecule Raman Scattering." Journal of Physical Chemistry A 122, no. 37:7437-7442. PNNL-SA-135554. doi:10.1021/acs.jpca.8b05912
Bhattarai A., A.V. Krayev, A. Temiryazev, D. Evplov, K.T. Crampton, W.P. Hess, and P.Z. El-Khoury. 2018. "Tip-Enhanced Raman Scattering from Nanopatterned Graphene and Graphene Oxide." Nano Letters 18, no. 6:4029-4033. PNNL-SA-134494. doi:10.1021/acs.nanolett.8b01690
Zhu Y., C. Ophus, M.B. Toloczko, and D.J. Edwards. 2018. "Towards bend-contour-free dislocation imaging via diffraction contrast STEM." Ultramicroscopy 193. PNNL-SA-131462. doi:10.1016/j.ultramic.2018.06.001
Garabedian A., P. Benigni, C. Ramirez, E.M. Baker, T. Liu, R.D. Smith, and F. Fernandez-Lima. 2018. "Towards Discovery and Targeted Peptide Biomarker Detection Using nanoESI-TIMS-TOF MS." Journal of the American Society for Mass Spectrometry 29, no. 5:817-826. PNNL-SA-129610. doi:10.1007/s13361-017-1787-8
Nguyen S.N., R.L. Sontag, J.P. Carson, R.A. Corley, C.K. Ansong, and J. Laskin. 2018. "Towards High-Resolution Tissue Imaging Using Nanospray Desorption Electrospray Ionization Mass Spectrometry Coupled to Shear Force Microscopy." Journal of the American Society for Mass Spectrometry 29, no. 2:316-322. PNNL-SA-126302. doi:10.1007/s13361-017-1750-8
Proetto M.T., C.E. Callmann, J.B. Cliff, C.J. Szymanski, D. Hu, S.B. Howell, and J.E. Evans, et al. 2018. "Tumor Retention of Enzyme-Responsive Pt(II) Drug-Loaded Nanoparticles Imaged by Nanoscale Secondary Ion Mass Spectrometry and Fluorescence Microscopy." ACS Central Science 4, no. 11:1477â1484. PNNL-SA-138579. doi:10.1021/acscentsci.8b00444
Wang L., K.A. Stoerzinger, L. Chang, J. Zhao, Y. Li, C. Tang, and X. Yin, et al. 2018. "Tuning Bifunctional Oxygen Electrocatalysts by Changing A-site Rare-Earth Element in Perovskite Nickelates." Advanced Functional Materials 28, no. 39:1803712. PNNL-SA-135288. doi:10.1002/adfm.201803712
Kaspar T.C., S. Hong, M.E. Bowden, T. Varga, P. Yan, C. Wang, and S.R. Spurgeon, et al. 2018. "Tuning piezoelectric properties through epitaxy of La2Ti2O7 and related thin films." Scientific Reports 8. PNNL-SA-128769. doi:10.1038/s41598-018-21009-5
Wang Y., H. Guo, Q. Zheng, W.A. Al-Saidi, and J. Zhao. 2018. "Tuning Solvated Electrons by Polar-Nonpolar Oxide Heterostructure." Journal of Physical Chemistry Letters 9, no. 11:3049â3056. doi:10.1021/acs.jpclett.8b00938
Borders B., M. Adinehnia, B. Chilukuri, M. Ruf, K.W. Hipps, and U. Mazur. 2018. "Tuning the Optoelectronic Characteristics of Ionic Organic Crystalline Assemblies." Journal of Materials Chemistry C 6. doi:10.1039/c8tc00416a
Feng Y., R. Chen, J.C. Stegen, Z. Guo, J. Zhang, Z. Li, and X. Lin. 2018. "Two key features influencing community assembly processes at regional scale: Initial state and degree of change in environmental conditions." Molecular Ecology 27, no. 24:5238-5251. PNNL-SA-129546. doi:10.1111/mec.14914
Fu S., J. Song, C. Zhu, G.H. Xu, K. Amine, C. Sun, and X. Li, et al. 2018. "Ultrafine and Highly Disordered Ni2Fe1 Nanofoams Enabled Highly Efficient Oxygen Evolution Reaction in Alkaline Electrolyte." Nano Energy 44. PNNL-SA-126521. doi:10.1016/j.nanoen.2017.12.010
Shi Q., C. Zhu, M. Tian, D. Su, M. Fu, M.H. Engelhard, and J.S. Watts, et al. 2018. "Ultrafine Pd Ensembles Anchored-Au2Cu Aerogels Boost Ethanol Electrooxidation." Nano Energy 53. PNNL-SA-135816. doi:10.1016/j.nanoen.2018.08.047
Shi Q., C. Zhu, S. Feng, D. Du, J. Wang, H. Xia, and M.H. Engelhard, et al. 2018. "Ultrathin Dendritic IrTe Nanotubes for Efficient Oxygen Evolution Reaction with a Wide pH Range." Journal of Materials Chemistry A 6, no. 19:8855-8859. PNNL-SA-130853. doi:10.1039/c8ta01288a
May N.W., M.J. Gunsch, N.E. Olson, A.L. Bondy, R.M. Kirpes, S. Bertman, and S. China, et al. 2018. "Unexpected contributions of sea spray and lake spray aerosol to inland particulate matter." Environmental Science & Technology Letters 5, no. 7:405-412. PNNL-SA-132459. doi:10.1021/acs.estlett.8b00254
Nagy G., I.K. Attah, V. Garimella, K. Tang, Y.M. Ibrahim, E.M. Baker, and R.D. Smith. 2018. "Unraveling the Isomeric Heterogeneity of Glycans: Ion Mobility Separations in Structures for Lossless Ion Manipulations." Chemical Communications 54, no. 83:11701-11704. PNNL-SA-137134. doi:10.1039/C8CC06966B
Galib M., G.K. Schenter, C.J. Mundy, N. Govind, and J.L. Fulton. 2018. "Unraveling the Spectral Signatures of Solvent Ordering in K-edge XANES of Aqueous Na+." Journal of Chemical Physics 149, no. 12:Article Number 124503. PNNL-SA-131808. doi:10.1063/1.5024568
Zheng X., K.T. Dupuis, N.A. Aly, Y. Zhou, F.B. Smith, K. Tang, and R.D. Smith, et al. 2018. "Utilizing Ion Mobility Spectrometry and Mass Spectrometry for the Analysis of Polycyclic Aromatic Hydrocarbons, Polychlorinated Biphenyls, Polybrominated Diphenyl Ethers and Their Metabolites." Analytical Chimica Acta 1037. PNNL-SA-130591. doi:10.1016/j.aca.2018.02.054
Tfaily M.M., R.M. Wilson, W.T. Cooper, J.E. Kostka, P.J. Hanson, and J. Chanton. 2018. "Vertical Stratification of Peat Pore Water Dissolved Organic Matter composition in a peat bog in Northern Minnesota." Journal of Geophysical Research. Biogeosciences 123, no. 2:479-494. PNNL-SA-132063. doi:10.1002/2017JG004007
Therrien A.J., K.J. Groden, A.J. Hensley, A.C. Schilling, R.T. Hannagan, M.D. Marcinkowski, and A. Pronschinske, et al. 2018. "Water Activation by Single Pt Atoms Supported on a Cu2O Thin Film." Journal of Catalysis 364. doi:10.1016/j.jcat.2018.04.024
Szanyi J., D. Mei, T. Varga, C. Peden, I. Heo, S.H. Oh, and C.H. Kim. 2018. "Where does the sulphur go? Deactivation of a low temperature CO oxidation catalyst by sulphur poisoning." Catalysis Letters 148, no. 5:1445-1450. PNNL-SA-130691. doi:10.1007/s10562-018-2343-2
Stegen J.C., and A.E. Goldman. 2018. "WHONDRS: A community resource for studying dynamic river corridors." mSystems 3, no. 5:Article Number e00151-18. PNNL-SA-136150. doi:10.1128/mSystems.00151-18
Shi D., H. Wang, L. Kovarik, F. Gao, C. Wan, J.Z. Hu, and Y. Wang. 2018. "WOx supported on gamma-Al2O3 with different morphologies as model catalysts for alkanol dehydration." Journal of Catalysis 363. PNNL-SA-132764. doi:10.1016/j.jcat.2018.04.004
Stifler C., N. Kollin Wittig, M. Sassi, C. Sun, M.A. Marcus, H. Birkedal, and E. Beniash, et al. 2018. "X-ray Linear Dichroism in Apatite." Journal of the American Chemical Society 140, no. 37:11698-11704. PNNL-SA-131664. doi:10.1021/jacs.8b05547
Naas A., L. Solden, A.D. Norbeck, H.M. Brewer, L. Hagen, I. Heggenes, and A. Mchardy, et al. 2018. "âCandidatus Paraporphyromonas polyenzymogenesâ encodes multi-modular cellulases linked to the type IX secretion system." Microbiome 6. PNNL-SA-129531. doi:10.1186/s40168-018-0421-8

2017

Gao H., A. Makarov, and R.D. Smith. 2017. "2016 ASMS Workshop Review: Next Generation LC/MS: Critical Insights and Future Perspectives." Journal of the American Society for Mass Spectrometry 28, no. 7:1248-1249. PNNL-SA-125969. doi:10.1007/s13361-017-1664-5
Gao H, A Makarov, and RD Smith.2017."2016 ASMS Workshop Review: Next Generation LC/MS: Critical Insights and Future Perspectives."Journal of the American Society for Mass Spectrometry 28(7):1248-1249. doi:10.1007/s13361-017-1664-5
Hu J.Z., C. Wan, A. Vjunov, M. Wang, Z. Zhao, M.Y. Hu, and D.M. Camaioni, et al. 2017. "27Al MAS NMR Studies of HBEA Zeolite at Low to High Magnetic Fields." Journal of Physical Chemistry C 121, no. 23:12849â12854. PNNL-SA-125685. doi:10.1021/acs.jpcc.7b03517
Hu JZ, C Wan, A Vjunov, M Wang, Z Zhao, MY Hu, DM Camaioni, and JA Lercher.2017."27Al MAS NMR Studies of HBEA Zeolite at Low to High Magnetic Fields."Journal of Physics Chemistry C 121(23):1284912854. doi:10.1021/acs.jpcc.7b03517
Kennedy Z.C., J.F. Christ, K.A. Evans, B.W. Arey, L.E. Sweet, M.G. Warner, and R.L. Erikson, et al. 2017. "3D-Printed Poly(vinylidene fluoride) / Carbon Nanotube Composites as a Tunable, Low-Cost Chemical Vapour Sensing Platform." Nanoscale 9, no. 17:5458-5466. PNNL-SA-123459. doi:10.1039/C7NR00617A
Ren Z., F. Peng, B. Chen, D. Mei, and J. Li. 2017. "A combined experimental and computational study of water-gas shift reaction over rod-shaped Ce0.75M0.25O2 (M = Ti, Zr, and Mn) supported Cu catalysts." International Journal of Hydrogen Energy 42, no. 51:30086-30097. PNNL-SA-129864. doi:10.1016/j.ijhydene.2017.10.047
Siljestrom S., M.N. Parenteau, L.L. Jahnke, and S.L. Cady. 2017. "A comparative ToF-SIMS and GCâMS analysis of phototrophic communities collected from an alkaline silica-depositing hot spring." Organic Geochemistry 109. PNNL-SA-127253. doi:10.1016/j.orggeochem.2017.03.009
Hawely A.K., M. Torres Beltran, E. Zaikova, D.A. Walsh, A. Mueller, M. Scofield, and S. Kheirandish, et al. 2017. "A compendium of multi-omic sequence information from the Saanich Inlet water column." Scientific Data 4. PNNL-SA-121885. doi:10.1038/sdata.2017.160
Jin Y., M. Fei, S. Rosenquist, L. Jin, S. Gohil, C. Sandstrom, and H. Olsson, et al. 2017. "A Dual-Promoter Gene Orchestrates the Sucrose-Coordinated Synthesis of Starch and Fructan in Barley." Molecular Plant 10, no. 12:1556-1570. PNNL-SA-130518. doi:10.1016/j.molp.2017.10.013
Hill E.A., W.B. Chrisler, A.S. Beliaev, and H.C. Bernstein. 2017. "A flexible microbial co-culture platform for simultaneous utilization of methane and carbon dioxide from gas feedstocks." Bioresource Technology 228. PNNL-SA-122746. doi:10.1016/j.biortech.2016.12.111
Hill EA, WB Chrisler, AS Beliaev, and HC Bernstein.2017."A flexible microbial co-culture platform for simultaneous utilization of methane and carbon dioxide from gas feedstocks."Bioresource Technology 228:250-256. doi:10.1016/j.biortech.2016.12.111
Kou Q., S. Wu, N. Tolic, L. Pasa Tolic, Y. Liu, and X. Liu. 2017. "A mass graph-based approach for the identification of modified proteoforms using top-down tandem mass spectra." Bioinformatics 33, no. 9:1309-1316. PNNL-SA-123090. doi:10.1093/bioinformatics/btw806
Kou Q, S Wu, N Tolic, L Pasa Tolic, Y Liu, and X Liu.2017."A mass graph-based approach for the identification of modified proteoforms using top-down tandem mass spectra."Bioinformatics 33(9):1309-1316. doi:10.1093/bioinformatics/btw806
Haitjema C., S.P. Gilmore, J.K. Henske, K.V. Solomon, R.D. Groot, A. Kuo, and S.J. Mondo, et al. 2017. "A Parts List for Fungal Cellulosomes Revealed by Comparative Genomics." Nature Microbiology 2. PNNL-SA-120227. doi:10.1038/nmicrobiol.2017.87
Haitjema C, SP Gilmore, JK Henske, KV Solomon, RD Groot, A Kuo, SJ Mondo, A Salamov, KM LaButti, ZJ Zhao, J Chiniquy, KW Barry, HM Brewer, SO Purvine, AT Wright, M Hainaut, B Boxma, TA Van Alen, J Hackstein, B Henrissat, SE Baker, IV Grigoriev, and MA O'Malley.2017."A Parts List for Fungal Cellulosomes Revealed by Comparative Genomics."Nature Microbiology 2:Article No. 17087. doi:10.1038/nmicrobiol.2017.87
Aiona P.K., H. Lee, P. Lin, F.D. Heller, A. Laskin, J. Laskin, and S.A. Nizkorodov. 2017. "A Role for 2-Methyl Pyrrole in the Browning of 4-Oxopentanal and Limonene Secondary Organic Aerosol." Environmental Science & Technology 51, no. 19:11048â11056. PNNL-SA-126022. doi:10.1021/acs.est.7b02293
Zheng X., N.A. Aly, Y. Zhou, K.T. Dupuis, A. Bilbao Pena, V.L. Paurus, and D.J. Orton, et al. 2017. "A structural examination and collision cross section database for over 500 metabolites and xenobiotics using drift tube ion mobility spectrometry." Chemical Science 8, no. 11:7724-7736. PNNL-SA-126802. doi:10.1039/C7SC03464D
Qiu J., K. Yu, X. Fei, Y. Liu, E.S. Nakayasu, P.D. Piehowski, and J.B. Shaw, et al. 2017. "A unique deubiquitinase that deconjugates phosphoribosyl-linked protein ubiquitination." Cell Research 27, no. 7:865-881. PNNL-SA-123995. doi:10.1038/cr.2017.66
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