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Reductive dechlorination of 1,1,2,2-tetrachloroethane.
Arnold WA, Winget P, Cramer CJ. Arnold WA, et al. Among authors: cramer cj. Environ Sci Technol. 2002 Aug 15;36(16):3536-41. doi: 10.1021/es025655+. Environ Sci Technol. 2002. PMID: 12214646
Defining the Macromolecules of Tomorrow through Synergistic Sustainable Polymer Research.
Haque FM, Ishibashi JSA, Lidston CAL, Shao H, Bates FS, Chang AB, Coates GW, Cramer CJ, Dauenhauer PJ, Dichtel WR, Ellison CJ, Gormong EA, Hamachi LS, Hoye TR, Jin M, Kalow JA, Kim HJ, Kumar G, LaSalle CJ, Liffland S, Lipinski BM, Pang Y, Parveen R, Peng X, Popowski Y, Prebihalo EA, Reddi Y, Reineke TM, Sheppard DT, Swartz JL, Tolman WB, Vlaisavljevich B, Wissinger J, Xu S, Hillmyer MA. Haque FM, et al. Among authors: cramer cj. Chem Rev. 2022 Mar 23;122(6):6322-6373. doi: 10.1021/acs.chemrev.1c00173. Epub 2022 Feb 8. Chem Rev. 2022. PMID: 35133803
Software for the frontiers of quantum chemistry: An overview of developments in the Q-Chem 5 package.
Epifanovsky E, Gilbert ATB, Feng X, Lee J, Mao Y, Mardirossian N, Pokhilko P, White AF, Coons MP, Dempwolff AL, Gan Z, Hait D, Horn PR, Jacobson LD, Kaliman I, Kussmann J, Lange AW, Lao KU, Levine DS, Liu J, McKenzie SC, Morrison AF, Nanda KD, Plasser F, Rehn DR, Vidal ML, You ZQ, Zhu Y, Alam B, Albrecht BJ, Aldossary A, Alguire E, Andersen JH, Athavale V, Barton D, Begam K, Behn A, Bellonzi N, Bernard YA, Berquist EJ, Burton HGA, Carreras A, Carter-Fenk K, Chakraborty R, Chien AD, Closser KD, Cofer-Shabica V, Dasgupta S, de Wergifosse M, Deng J, Diedenhofen M, Do H, Ehlert S, Fang PT, Fatehi S, Feng Q, Friedhoff T, Gayvert J, Ge Q, Gidofalvi G, Goldey M, Gomes J, González-Espinoza CE, Gulania S, Gunina AO, Hanson-Heine MWD, Harbach PHP, Hauser A, Herbst MF, Hernández Vera M, Hodecker M, Holden ZC, Houck S, Huang X, Hui K, Huynh BC, Ivanov M, Jász Á, Ji H, Jiang H, Kaduk B, Kähler S, Khistyaev K, Kim J, Kis G, Klunzinger P, Koczor-Benda Z, Koh JH, Kosenkov D, Koulias L, Kowalczyk T, Krauter CM, Kue K, Kunitsa A, Kus T, Ladjánszki I, Landau A, Lawler KV, Lefrancois D, Lehtola S, Li RR, Li YP, Liang J, Liebenthal M, Lin HH, Lin YS, Liu F, Liu KY, Loipersberger M, Luenser A, Manjanat… See abstract for full author list ➔ Epifanovsky E, et al. Among authors: cramer cj. J Chem Phys. 2021 Aug 28;155(8):084801. doi: 10.1063/5.0055522. J Chem Phys. 2021. PMID: 34470363 Free PMC article.
Demonstration of tunable reactivity for meta-benzynes.
Nash JJ, Nizzi KE, Adeuya A, Yurkovich MJ, Cramer CJ, Kenttämaa HI. Nash JJ, et al. Among authors: cramer cj. J Am Chem Soc. 2005 Apr 27;127(16):5760-1. doi: 10.1021/ja0449473. J Am Chem Soc. 2005. PMID: 15839653
291 results