Research Output

2020

Ion Mobility Mass Spectrometry as an Efficient Tool for Identification of Streptorubin B in Streptomyces coelicolor M145

Marshall, A. P., Johnson, A. R., Vega, M. M., Thomson, R. J. & Carlson, E. E., Jan 24 2020, In : Journal of Natural Products. 83, 1, p. 159-163 5 p.

Research output: Contribution to journalArticle

M06-SX screened-exchange density functional for chemistry and solid-state physics

Wang, Y., Verma, P., Zhang, L., Li, Y., Liu, Z., Truhlar, D. G. & He, X., Feb 4 2020, In : Proceedings of the National Academy of Sciences of the United States of America. 117, 5, p. 2294-2301 8 p.

Research output: Contribution to journalArticle

1 Scopus citations

M11plus, a Range-Separated Hybrid Meta Functional Incorporating Nonlocal Rung-3.5 Correlation, Exhibits Broad Accuracy on Diverse Databases

Janesko, B. G., Verma, P., Scalmani, G., Frisch, M. J. & Truhlar, D. G., Apr 16 2020, In : Journal of Physical Chemistry Letters. 11, 8, p. 3045-3050 6 p.

Research output: Contribution to journalArticle

Mechanism of Initiation Stereocontrol in Polymerization of rac-Lactide by Aluminum Complexes Supported by Indolide-Imine Ligands

Luke, A. M., Peterson, A., Chiniforoush, S., Mandal, M., Popowski, Y., Sajjad, H., Bouchey, C. J., Shopov, D. Y., Graziano, B. J., Yao, L. J., Cramer, C. J., Reineke, T. M. & Tolman, W. B., Mar 10 2020, In : Macromolecules. 53, 5, p. 1809-1818 10 p.

Research output: Contribution to journalArticle

Mechanistic Studies of Bioorthogonal ATP Analogues for Assessment of Histidine Kinase Autophosphorylation

Espinasse, A., Wen, X., Goodpaster, J. D. & Carlson, E. E., Jan 1 2020, (Accepted/In press) In : ACS Chemical Biology.

Research output: Contribution to journalArticle

Methylcellulose fibrils: a mini review

Morozova, S., Feb 1 2020, In : Polymer International. 69, 2, p. 125-130

Research output: Contribution to journalArticle

Molecular Engineering of Nanostructures in Disordered Block Polymers

Hampu, N. & Hillmyer, M. A., Mar 17 2020, In : ACS Macro Letters. 9, 3, p. 382-388 7 p.

Research output: Contribution to journalArticle

Multicomponent Pyrazole Synthesis from Alkynes, Nitriles, and Titanium Imido Complexes via Oxidatively Induced N-N Bond Coupling

Pearce, A. J., Harkins, R. P., Reiner, B. R., Wotal, A. C., Dunscomb, R. J. & Tonks, I. A., Jan 1 2020, (Accepted/In press) In : Journal of the American Chemical Society.

Research output: Contribution to journalArticle

Multidimensional Nanoparticle Characterization through Ion Mobility-Mass Spectrometry

Li, C., Lee, A. L., Chen, X., Pomerantz, W. C. K., Haynes, C. L. & Hogan, C. J., Feb 4 2020, In : Analytical chemistry. 92, 3, p. 2503-2510 8 p.

Research output: Contribution to journalArticle

Multistep Reaction Pathway for CO2 Reduction on Hydride-Capped Si Nanosheets

Xia, L., Liao, X., He, Q., Wang, H., Zhao, Y. & Truhlar, D. G., Feb 6 2020, In : ChemCatChem. 12, 3, p. 722-725 4 p.

Research output: Contribution to journalArticle

1 Scopus citations

Nanostructured Polymer Monoliths for Biomedical Delivery Applications

Xie, Y. & Hillmyer, M. A., Jan 1 2020, (Accepted/In press) In : ACS Applied Bio Materials.

Research output: Contribution to journalArticle

Next-generation polymers: Isosorbide as a renewable alternative

Saxon, D. J., Luke, A. M., Sajjad, H., Tolman, W. B. & Reineke, T. M., Feb 2020, In : Progress in Polymer Science. 101, 101196.

Research output: Contribution to journalReview article

Open Access
1 Scopus citations

Nickel enrichment of next-generation NMC nanomaterials alters material stability, causing unexpected dissolution behavior and observed toxicity to: S. oneidensis MR-1 and D. magna

Buchman, J. T., Bennett, E. A., Wang, C., Abbaspour Tamijani, A., Bennett, J. W., Hudson, B. G., Green, C. M., Clement, P. L., Zhi, B., Henke, A. H., Laudadio, E. D., Mason, S. E., Hamers, R. J., Klaper, R. D. & Haynes, C. L., Feb 2020, In : Environmental Science: Nano. 7, 2, p. 571-587 17 p.

Research output: Contribution to journalArticle

1 Scopus citations

One-dimensional intergrowths in two-dimensional zeolite nanosheets and their effect on ultra-selective transport

Kumar, P., Kim, D. W., Rangnekar, N., Xu, H., Fetisov, E. O., Ghosh, S., Zhang, H., Xiao, Q., Shete, M., Siepmann, J. I., Dumitrica, T., Mccool, B., Tsapatsis, M. & Mkhoyan, K. A., Apr 1 2020, In : Nature Materials. 19, 4, p. 443-449

Research output: Contribution to journalArticle

2 Scopus citations

Periodic Electronic Structure Calculations with the Density Matrix Embedding Theory

Pham, H. Q., Hermes, M. R. & Gagliardi, L., Jan 14 2020, In : Journal of Chemical Theory and Computation. 16, 1, p. 130-140 11 p.

Research output: Contribution to journalArticle

Phosphorescent heteroleptic iridium(III) cyclometallates: Improved syntheses of acetylacetonate complexes and quantum chemical studies of their excited state properties

Sanner, R. D., Cherepy, N. J., Pham, H. Q. & Young, V. G., Jan 15 2020, In : Polyhedron. 176, 114256.

Research output: Contribution to journalArticle

Photochemical Transformations of Carbon Dots in Aqueous Environments

Frank, B. P., Sigmon, L. R., Deline, A. R., Lankone, R. S., Gallagher, M. J., Zhi, B., Haynes, C. L. & Fairbrother, D. H., Apr 7 2020, In : Environmental Science and Technology. 54, 7, p. 4160-4170 11 p.

Research output: Contribution to journalArticle

Poly(methyl methacrylate) Films with High Concentrations of Silicon Quantum Dots for Visibly Transparent Luminescent Solar Concentrators

Hill, S. K. E., Connell, R., Held, J., Peterson, C., Francis, L., Hillmyer, M. A., Ferry, V. E. & Kortshagen, U., Jan 29 2020, In : ACS Applied Materials and Interfaces. 12, 4, p. 4572-4578 7 p.

Research output: Contribution to journalArticle

Polyplexes Are Endocytosed by and Trafficked within Filopodia

Ingle, N. P., Hexum, J. K. & Reineke, T. M., Apr 13 2020, In : Biomacromolecules. 21, 4, p. 1379-1392 14 p.

Research output: Contribution to journalArticle

Preparation of Scalable Silica-Coated Iron Oxide Nanoparticles for Nanowarming

Gao, Z., Ring, H. L., Sharma, A., Namsrai, B., Tran, N., Finger, E. B., Garwood, M., Haynes, C. L. & Bischof, J. C., Feb 1 2020, In : Advanced Science. 7, 4, 1901624.

Research output: Contribution to journalArticle

Open Access

Present and future of surface-enhanced Raman scattering

Langer, J., de Aberasturi, D. J., Aizpurua, J., Alvarez-Puebla, R. A., Auguié, B., Baumberg, J. J., Bazan, G. C., Bell, S. E. J., Boisen, A., Brolo, A. G., Choo, J., Cialla-May, D., Deckert, V., Fabris, L., Faulds, K., Javier García de Abajo, F., Goodacre, R., Graham, D., Haes, A. J., Haynes, C. L. & 39 others, Huck, C., Itoh, T., Käll, M., Kneipp, J., Kotov, N. A., Kuang, H., Le Ru, E. C., Lee, H. K., Li, J. F., Ling, X. Y., Maier, S. A., Mayerhöfer, T., Moskovits, M., Murakoshi, K., Nam, J. M., Nie, S., Ozaki, Y., Pastoriza-Santos, I., Perez-Juste, J., Popp, J., Pucci, A., Reich, S., Ren, B., Schatz, G. C., Shegai, T., Schlücker, S., Tay, L. L., George Thomas, K., Tian, Z. Q., van Duyne, R. P., Vo-Dinh, T., Wang, Y., Willets, K. A., Xu, C., Xu, H., Xu, Y., Yamamoto, Y. S., Zhao, B. & Liz-Marzán, L. M., Jan 28 2020, In : ACS nano. 14, 1, p. 28-117 90 p.

Research output: Contribution to journalReview article

Open Access
39 Scopus citations

Probing Enhanced Exciton Diffusion in a Triplet-Sensitized Organic Photovoltaic Cell

Shi, K., Curtin, I. J., Healy, A. T., Zhang, T., Rai, D., Blank, D. A. & Holmes, R. J., Feb 13 2020, In : Journal of Physical Chemistry C. 124, 6, p. 3489-3495 7 p.

Research output: Contribution to journalArticle

Processable epoxy-telechelic polyalkenamers and polyolefins for photocurable elastomers

Kassekert, L. A., Dingwell, C. E., De Hoe, G. X. & Hillmyer, M. A., Jan 21 2020, In : Polymer Chemistry. 11, 3, p. 712-720 9 p.

Research output: Contribution to journalArticle

Reactions of HDDA Benzynes with C,N-Diarylimines (ArCH=NAr')

Arora, S., Sneddon, D. S. & Hoye, T. R., Jan 1 2020, (Accepted/In press) In : European Journal of Organic Chemistry.

Research output: Contribution to journalArticle

Reactivity of terminal imido complexes of group 4–6 metals: Stoichiometric and catalytic reactions involving cycloaddition with unsaturated organic molecules

Kawakita, K., Parker, B. F., Kakiuchi, Y., Tsurugi, H., Mashima, K., Arnold, J. & Tonks, I. A., Mar 15 2020, In : Coordination Chemistry Reviews. 407, 213118.

Research output: Contribution to journalReview article

Readily Degradable Aromatic Polyesters from Salicylic Acid

Kim, H. J., Reddi, Y., Cramer, C. J., Hillmyer, M. A. & Ellison, C. J., Jan 21 2020, In : ACS Macro Letters. 9, 1, p. 96-102 7 p.

Research output: Contribution to journalArticle

Reduced surface adsorption in 3D printed acrylonitrile butadiene styrene micro free-flow electrophoresis devices

Anciaux, S. K. & Bowser, M. T., Feb 1 2020, In : ELECTROPHORESIS. 41, 3-4, p. 225-234 10 p.

Research output: Contribution to journalArticle

Retraction: Pushing single-oxygen-atom-bridged bimetallic systems to the right: A cryptand-encapsulated Co-O-Co unit (Journal of the American Chemical Society (2015) 137:49 (15354-15357) DOI: 10.1021/jacs.5b09827)

Stauber, J. M., Bloch, E. D., Vogiatzis, K. D., Zheng, S. L., Hadt, R. G., Hayes, D., Chen, L. X., Gagliardi, L., Nocera, D. G. & Cummins, C. C., Apr 8 2020, In : Journal of the American Chemical Society. 142, 14, 1 p.

Research output: Contribution to journalComment/debate

Open Access

Robust, Accurate, and Efficient: Quantum Embedding Using the Huzinaga Level-Shift Projection Operator for Complex Systems

Graham, D. S., Wen, X., Chulhai, D. V. & Goodpaster, J. D., Apr 14 2020, In : Journal of Chemical Theory and Computation. 16, 4, p. 2284-2295 12 p.

Research output: Contribution to journalArticle

Sc3+-Promoted O-O Bond Cleavage of a (μ-1,2-Peroxo)diiron(III) Species Formed from an Iron(II) Precursor and O2 to Generate a Complex with an FeIV 2(μ-O)2 Core

Banerjee, S., Draksharapu, A., Crossland, P. M., Fan, R., Guo, Y., Swart, M. & Que, L., Jan 1 2020, (Accepted/In press) In : Journal of the American Chemical Society.

Research output: Contribution to journalArticle

1 Scopus citations

Size Control of the MOF NU-1000 through Manipulation of the Modulator/Linker Competition

Webber, T. E., Desai, S. P., Combs, R. L., Bingham, S., Lu, C. C. & Penn, R. L., May 6 2020, In : Crystal Growth and Design. 20, 5, p. 2965-2972 8 p.

Research output: Contribution to journalArticle

Open Access

Spatial Distribution of PEO-PPO-PEO Block Copolymer and PEO Homopolymer in Lipid Bilayers

Kim, M., Heinrich, F., Haugstad, G., Yu, G., Yuan, G., Satija, S. K., Zhang, W., Seo, H. S., Metzger, J. M., Azarin, S. M., Lodge, T. P., Hackel, B. J. & Bates, F. S., Apr 7 2020, In : Langmuir. 36, 13, p. 3393-3403

Research output: Contribution to journalArticle

Splice switching an oncogenic ratio of SmgGDS isoforms as a strategy to diminish malignancy

Brandt, A. C., McNally, L., Lorimer, E. L., Unger, B., Koehn, O. J., Suazo, K. F., Rein, L., Szabo, A., Tsaih, S. W., Distefano, M. D., Flister, M. J., Rigo, F., McNally, M. T. & Williams, C. L., Feb 18 2020, In : Proceedings of the National Academy of Sciences of the United States of America. 117, 7, p. 3627-3636 10 p.

Research output: Contribution to journalArticle

Status and Challenges of Density Functional Theory

Verma, P. & Truhlar, D. G., Apr 2020, In : Trends in Chemistry. 2, 4, p. 302-318 17 p.

Research output: Contribution to journalReview article

Open Access

Structural considerations for charge-enhanced Brønsted acid catalysts

Payne, C. & Kass, S. R., Jan 1 2020, (Accepted/In press) In : Journal of Physical Organic Chemistry.

Research output: Contribution to journalArticle

Studies towards the Total Synthesis of Drimentine C. Preparation of the AB and CDEF Ring Fragments

Pound, S. M., Underwood, S. J. & Douglas, C. J., Jan 1 2020, (Accepted/In press) In : European Journal of Organic Chemistry.

Research output: Contribution to journalArticle

Synthesis and characterization of tantalum-based early-late heterobimetallic complexes supported by 2-(diphenylphosphino)pyrrolide ligands

Dunn, P. L., Beaumier, E. P. & Tonks, I. A., May 1 2020, In : Polyhedron. 181, 114471.

Research output: Contribution to journalArticle

Synthesis and characterization of tetrairidium clusters in the metal organic framework UiO-67: Catalyst for ethylene hydrogenation

Yang, D., Gaggioli, C. A., Conley, E., Babucci, M., Gagliardi, L. & Gates, B. C., Feb 2020, In : Journal of Catalysis. 382, p. 165-172 8 p.

Research output: Contribution to journalArticle

The aza-hexadehydro-diels-alder reaction

Thompson, S. K. & Hoye, T. R., Jan 1 2020, In : Journal of the American Chemical Society. 141, 50, p. 19575-19580 6 p.

Research output: Contribution to journalArticle

The Ligand Cap Affects the Coordination Number but Not Necessarily the Affinity for Anions of Tris-Bidentate Europium Complexes

Huang, S. Y., Qian, M. & Pierre, V. C., Mar 16 2020, In : Inorganic chemistry. 59, 6, p. 4096-4108 13 p.

Research output: Contribution to journalArticle

The role of cations in uranyl nanocluster association: A molecular dynamics study

Newcomb, K., Bernales, V., Tiwari, S. P., Gagliardi, L. & Maginn, E. J., Jan 1 2020, In : Physical Chemistry Chemical Physics. 22, 4, p. 1847-1854 8 p.

Research output: Contribution to journalArticle

The Role of the Organic Solvent Polarity in Isolating Uranyl Peroxide Capsule Fragments

Arteaga, A., Ray, D., Glass, E., Martin, N. P., Zakharov, L. N., Gagliardi, L. & Nyman, M., Feb 3 2020, In : Inorganic chemistry. 59, 3, p. 1633-1641 9 p.

Research output: Contribution to journalArticle

The Synthesis Science of Targeted Vapor-Phase Metal-Organic Framework Postmodification

Kim, I. S., Ahn, S., Vermeulen, N. A., Webber, T. E., Gallington, L. C., Chapman, K. W., Penn, R. L., Hupp, J. T., Farha, O. K., Notestein, J. M. & Martinson, A. B. F., Jan 8 2020, In : Journal of the American Chemical Society. 142, 1, p. 242-250 9 p.

Research output: Contribution to journalArticle

The use of succinonitrile as an electrolyte additive for composite-fiber membranes in lithium-ion batteries

Villarreal, J., Chavez, R. O., Chopade, S. A., Lodge, T. P. & Alcoutlabi, M., Mar 2020, In : Membranes. 10, 3, 45.

Research output: Contribution to journalArticle

Open Access

The valence and Rydberg states of dienes

Ning, J. & Truhlar, D. G., Mar 21 2020, In : Physical Chemistry Chemical Physics. 22, 11, p. 6176-6183 8 p.

Research output: Contribution to journalArticle