Convergent ab initio analysis of the multi-channel HOBr + H reaction
Beck, Ian T, Lahm, Mitchell E, Douberly, Gary E, Schaefer, 3rd, Henry F
Published in The Journal of chemical physics (28.03.2024)
Published in The Journal of chemical physics (28.03.2024)
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Journal Article
Pericyclic reaction benchmarks: hierarchical computations targeting CCSDT(Q)/CBS and analysis of DFT performance
Vermeeren, Pascal, Dalla Tiezza, Marco, Wolf, Mark E, Lahm, Mitchell E, Allen, Wesley D, Schaefer, Henry F, Hamlin, Trevor A, Bickelhaupt, F. Matthias
Published in Physical chemistry chemical physics : PCCP (03.08.2022)
Published in Physical chemistry chemical physics : PCCP (03.08.2022)
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Journal Article
Structures and Energetics of E2H3 + (E = As, Sb, and Bi) Cations
Xia, Shu-Hua, He, Jihuan, Liu, Zhuoqun, Liu, Yunhan, Zhang, Yan, Xie, Yaoming, Lahm, Mitchell E., Robinson, Gregory H., Schaefer, Henry F.
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (25.01.2024)
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (25.01.2024)
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Journal Article
Structures and Energetics of E 2 H 3 + (E = As, Sb, and Bi) Cations
Xia, Shu-Hua, He, Jihuan, Liu, Zhuoqun, Liu, Yunhan, Zhang, Yan, Xie, Yaoming, Lahm, Mitchell E, Robinson, Gregory H, Schaefer, 3rd, Henry F
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (25.01.2024)
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (25.01.2024)
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Journal Article
Germanium(II) Dithiolene Complexes
Tran, Phuong M., Wang, Yuzhong, Lahm, Mitchell E., Wei, Pingrong, Molnar, Christopher J., Schaefer, Henry F., Robinson, Gregory H.
Published in Chemistry : a European journal (21.11.2023)
Published in Chemistry : a European journal (21.11.2023)
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Journal Article
Unusual nucleophilic reactivity of a dithiolene-based N-heterocyclic silane
Tran, Phuong M, Wang, Yuzhong, Lahm, Mitchell E, Wei, Pingrong, Schaefer, Henry F, Robinson, Gregory H
Published in Dalton transactions : an international journal of inorganic chemistry (02.04.2024)
Published in Dalton transactions : an international journal of inorganic chemistry (02.04.2024)
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Journal Article
From Carbene-Dithiolene Zwitterion Mediated B-H Bond Activation to BH 3 ·SMe 2 -Assisted Boron-Boron Bond Formation
Wang, Yuzhong, Tran, Phuong M, Lahm, Mitchell E, Wei, Pingrong, Adams, Earle R, Schaefer, 3rd, Henry F, Robinson, Gregory H
Published in Organometallics (11.12.2023)
Published in Organometallics (11.12.2023)
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Journal Article
From Carbene-Dithiolene Zwitterion Mediated B–H Bond Activation to BH3·SMe2‑Assisted Boron–Boron Bond Formation
Wang, Yuzhong, Tran, Phuong M., Lahm, Mitchell E., Wei, Pingrong, Adams, Earle R., Schaefer, Henry F., Robinson, Gregory H.
Published in Organometallics (11.12.2023)
Published in Organometallics (11.12.2023)
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Journal Article
Concordant Mode Approach for Molecular Vibrations
Lahm, Mitchell E., Kitzmiller, Nathaniel L., Mull, Henry F., Allen, Wesley D., Schaefer, Henry F.
Published in Journal of the American Chemical Society (28.12.2022)
Published in Journal of the American Chemical Society (28.12.2022)
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Journal Article
A Stable Aluminum Tris(dithiolene) Triradical
Tran, Phuong M., Wang, Yuzhong, Dzikovski, Boris, Lahm, Mitchell E., Xie, Yaoming, Wei, Pingrong, Klepov, Vladislav V., Schaefer, Henry F., Robinson, Gregory H.
Published in Journal of the American Chemical Society (31.05.2024)
Published in Journal of the American Chemical Society (31.05.2024)
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Journal Article
Correction: Pericyclic reaction benchmarks: hierarchical computations targeting CCSDT(Q)/CBS and analysis of DFT performance
Vermeeren, Pascal, Dalla Tiezza, Marco, Wolf, Mark E, Lahm, Mitchell E, Allen, Wesley D, Schaefer, Henry F, Hamlin, Trevor A, Bickelhaupt, F. Matthias
Published in Physical chemistry chemical physics : PCCP (13.03.2024)
Published in Physical chemistry chemical physics : PCCP (13.03.2024)
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Journal Article
Activation of Ammonia by a Carbene-Stabilized Dithiolene Zwitterion
Wang, Yuzhong, Tran, Phuong M., Lahm, Mitchell E., Xie, Yaoming, Wei, Pingrong, Adams, Earle R., Glushka, John N., Ren, Zichun, Popik, Vladimir V., Schaefer, Henry F., Robinson, Gregory H.
Published in Journal of the American Chemical Society (14.09.2022)
Published in Journal of the American Chemical Society (14.09.2022)
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Journal Article
Substituted Ortho-Benzynes: Properties of the Triple Bond
Lahm, Mitchell E, Maynard, Ryan K, Turney, Justin M, Weinhold, Frank, Schaefer, Henry F
Published in Journal of organic chemistry (07.08.2020)
Published in Journal of organic chemistry (07.08.2020)
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Journal Article
The bismuth tetramer Bi 4 : the ν 3 key to experimental observation
Lahm, Mitchell E, Hoobler, Preston R, Turney, Justin M, Peterson, Kirk A, Schaefer, Henry F
Published in Physical chemistry chemical physics : PCCP (16.08.2018)
Published in Physical chemistry chemical physics : PCCP (16.08.2018)
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Journal Article
From Carbene-Dithiolene Zwitterion Mediated B-H Bond Activation to BH3middle dotSMe2-Assisted Boron-Boron Bond Formation
Wang, Yuzhong, Tran, Phuong M., Lahm, Mitchell E., Wei, Pingrong, Adams, Earle R., Schaefer III, Henry F., Robinson, Gregory H.
Published in Organometallics (11.10.2023)
Published in Organometallics (11.10.2023)
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Journal Article
Phosphine-Mediated Cleavage of Sulfur–Sulfur Bonds
Tran, Phuong M., Wang, Yuzhong, Xie, Yaoming, Wei, Pingrong, Lahm, Mitchell E., Robinson, Gregory H.
Published in Organometallics (28.11.2022)
Published in Organometallics (28.11.2022)
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Journal Article
Pericyclic reaction benchmarks: hierarchical computations targeting CCSDT(Q)/CBS and analysis of DFT performance
Vermeeren, Pascal, Dalla Tiezza, Marco, Wolf, Mark E., Lahm, Mitchell E., Allen, Wesley D., Schaefer, Henry F., Hamlin, Trevor A., Bickelhaupt, F. Matthias
Published in Physical chemistry chemical physics : PCCP (01.01.2022)
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Published in Physical chemistry chemical physics : PCCP (01.01.2022)
Journal Article
The bismuth tetramer Bi4: the ν3 key to experimental observation
Lahm, Mitchell E, Hoobler, Preston R, Turney, Justin M, Peterson, Kirk A, Schaefer, Henry F
Published in Physical chemistry chemical physics : PCCP (29.08.2018)
Published in Physical chemistry chemical physics : PCCP (29.08.2018)
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Journal Article