Correction to "Leveraging Regio- and Stereoselective C(sp ³ )-H Functionalization of Silyl Ethers to Train a Logistic Regression Classification Model for Predicting Site-Selectivity Bias".

Autor: Boni YT, Cammarota RC, Liao K, Sigman MS, Davies HML

Publikováno v: Journal of the American Chemical Society [J Am Chem Soc] 2024 Oct 09; Vol. 146 (40), pp. 27972. Date of Electronic Publication: 2024 Sep 29.

Leveraging Regio- and Stereoselective C(sp ³ )-H Functionalization of Silyl Ethers to Train a Logistic Regression Classification Model for Predicting Site-Selectivity Bias.

Autor: Boni YT; Department of Chemistry, Emory University, 1515 Dickey Drive, Atlanta, Georgia 30322, United States., Cammarota RC; Department of Chemistry, University of Utah, 315 South 1400 East, Salt Lake City, Utah 84112, United States., Liao K; Department of Chemistry, Emory University, 1515 Dickey Drive, Atlanta, Georgia 30322, United States., Sigman MS; Department of Chemistry, University of Utah, 315 South 1400 East, Salt Lake City, Utah 84112, United States., Davies HML; Department of Chemistry, Emory University, 1515 Dickey Drive, Atlanta, Georgia 30322, United States.

Publikováno v: Journal of the American Chemical Society [J Am Chem Soc] 2022 Aug 31; Vol. 144 (34), pp. 15549-15561. Date of Electronic Publication: 2022 Aug 17.

Mechanistically Guided Workflow for Relating Complex Reactive Site Topologies to Catalyst Performance in C-H Functionalization Reactions.

Autor: Cammarota RC; Department of Chemistry, University of Utah, 315 South 1400 East, Salt Lake City, Utah 84112, United States., Liu W; Department of Chemistry, Emory University, 1515 Dickey Drive, Atlanta, Georgia 30322, United States., Bacsa J; Department of Chemistry, Emory University, 1515 Dickey Drive, Atlanta, Georgia 30322, United States., Davies HML; Department of Chemistry, Emory University, 1515 Dickey Drive, Atlanta, Georgia 30322, United States., Sigman MS; Department of Chemistry, University of Utah, 315 South 1400 East, Salt Lake City, Utah 84112, United States.

Publikováno v: Journal of the American Chemical Society [J Am Chem Soc] 2022 Feb 02; Vol. 144 (4), pp. 1881-1898. Date of Electronic Publication: 2022 Jan 24.

Thermodynamic and kinetic studies of H 2 and N 2 binding to bimetallic nickel-group 13 complexes and neutron structure of a Ni(η ² -H 2 ) adduct.

Autor: Cammarota RC; Department of Chemistry , University of Minnesota-Twin Cities , 207 Pleasant Street SE , Minneapolis , Minnesota 55455 , USA . Email: clu@umn.edu., Xie J; Department of Chemistry , University of Minnesota-Twin Cities , 207 Pleasant Street SE , Minneapolis , Minnesota 55455 , USA . Email: clu@umn.edu.; Supercomputing Institute , Chemical Theory Center , University of Minnesota-Twin Cities , 207 Pleasant Street SE , Minneapolis , Minnesota 55455 , USA.; Key Laboratory of Cluster Science of Ministry of Education , School of Chemistry and Chemical Engineering , Beijing Institute of Technology , Beijing 100081 , China., Burgess SA; Catalysis Science Group , Pacific Northwest National Laboratory , P. O. Box 999 , MS K2-57 , Richland , Washington 99352 , USA., Vollmer MV; Department of Chemistry , University of Minnesota-Twin Cities , 207 Pleasant Street SE , Minneapolis , Minnesota 55455 , USA . Email: clu@umn.edu., Vogiatzis KD; Department of Chemistry , University of Minnesota-Twin Cities , 207 Pleasant Street SE , Minneapolis , Minnesota 55455 , USA . Email: clu@umn.edu.; Supercomputing Institute , Chemical Theory Center , University of Minnesota-Twin Cities , 207 Pleasant Street SE , Minneapolis , Minnesota 55455 , USA.; Department of Chemistry , University of Tennessee , Knoxville , Tennessee 37996 , USA., Ye J; Department of Chemistry , University of Minnesota-Twin Cities , 207 Pleasant Street SE , Minneapolis , Minnesota 55455 , USA . Email: clu@umn.edu.; Supercomputing Institute , Chemical Theory Center , University of Minnesota-Twin Cities , 207 Pleasant Street SE , Minneapolis , Minnesota 55455 , USA., Linehan JC; Catalysis Science Group , Pacific Northwest National Laboratory , P. O. Box 999 , MS K2-57 , Richland , Washington 99352 , USA., Appel AM; Catalysis Science Group , Pacific Northwest National Laboratory , P. O. Box 999 , MS K2-57 , Richland , Washington 99352 , USA., Hoffmann C; Neutron Scattering Division , Oak Ridge National Laboratory , Oak Ridge , Tennessee 37831 , USA., Wang X; Neutron Scattering Division , Oak Ridge National Laboratory , Oak Ridge , Tennessee 37831 , USA., Young VG Jr; Department of Chemistry , University of Minnesota-Twin Cities , 207 Pleasant Street SE , Minneapolis , Minnesota 55455 , USA . Email: clu@umn.edu., Lu CC; Department of Chemistry , University of Minnesota-Twin Cities , 207 Pleasant Street SE , Minneapolis , Minnesota 55455 , USA . Email: clu@umn.edu.

Publikováno v: Chemical science [Chem Sci] 2019 Jun 10; Vol. 10 (29), pp. 7029-7042. Date of Electronic Publication: 2019 Jun 10 (Print Publication: 2019).

A Bimetallic Nickel-Gallium Complex Catalyzes CO 2 Hydrogenation via the Intermediacy of an Anionic d ¹⁰ Nickel Hydride.

Autor: Cammarota RC; Department of Chemistry, University of Minnesota , 207 Pleasant Street SE, Minneapolis, Minnesota 55455, United States., Vollmer MV; Department of Chemistry, University of Minnesota , 207 Pleasant Street SE, Minneapolis, Minnesota 55455, United States., Xie J; Department of Chemistry, University of Minnesota , 207 Pleasant Street SE, Minneapolis, Minnesota 55455, United States.; Supercomputing Institute and Chemical Theory Center, University of Minnesota , Minneapolis, Minnesota 55455, United States., Ye J; Department of Chemistry, University of Minnesota , 207 Pleasant Street SE, Minneapolis, Minnesota 55455, United States.; Supercomputing Institute and Chemical Theory Center, University of Minnesota , Minneapolis, Minnesota 55455, United States., Linehan JC; Pacific Northwest National Laboratory , P.O. Box 999, MS K2-57, Richland, Washington 99352, United States., Burgess SA; Pacific Northwest National Laboratory , P.O. Box 999, MS K2-57, Richland, Washington 99352, United States., Appel AM; Pacific Northwest National Laboratory , P.O. Box 999, MS K2-57, Richland, Washington 99352, United States., Gagliardi L; Department of Chemistry, University of Minnesota , 207 Pleasant Street SE, Minneapolis, Minnesota 55455, United States.; Supercomputing Institute and Chemical Theory Center, University of Minnesota , Minneapolis, Minnesota 55455, United States., Lu CC; Department of Chemistry, University of Minnesota , 207 Pleasant Street SE, Minneapolis, Minnesota 55455, United States.

Publikováno v: Journal of the American Chemical Society [J Am Chem Soc] 2017 Oct 11; Vol. 139 (40), pp. 14244-14250. Date of Electronic Publication: 2017 Sep 28.