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Journal of the American Chemical Society
|
February 21, 2018
Structure and Dynamics of Zr<sub>6</sub>O<sub>8</sub> Metal-Organic Framework Node Surfaces Probed with Ethanol Dehydration as a Catalytic Test Reaction
Dong Yang, Manuel A Ortuño, Varinia Bernales, et al.
Science (New York, N.Y.)
|
February 2, 2002
A carbon-free sandwich complex [(P5)2Ti]2-
Eugenijus Urnius, William W Brennessel, Christopher J Cramer, et al.
Journal of Chemical Theory and Computation
|
November 20, 2015
Ab Initio Extension of the AMOEBA Polarizable Force Field to Fe(2.)
David Semrouni, William C Isley, Carine Clavaguéra, et al.
Inorganic Chemistry
|
November 12, 2019
Carboxylate Structural Effects on the Properties and Proton-Coupled Electron Transfer Reactivity of [CuO<sub>2</sub>CR]<sup>2+</sup> Cores
Courtney E Elwell, Mukunda Mandal, Caitlin J Bouchey, et al.
Journal of the American Chemical Society
|
November 18, 2015
Length-Dependent Nanotransport and Charge Hopping Bottlenecks in Long Thiophene-Containing π-Conjugated Molecular Wires
Christopher E Smith, Samuel O Odoh, Soumen Ghosh, et al.
Angewandte Chemie (International Ed. in English)
|
December 18, 2018
Facile Conversion of syn-[Fe<sup>IV</sup> (O)(TMC)]<sup>2+</sup> into the anti Isomer via Meunier's Oxo-Hydroxo Tautomerism Mechanism
Jai Prakash, Yuan Sheng, Apparao Draksharapu, et al.
Journal of the American Chemical Society
|
October 19, 2011
Rapid C-H bond activation by a monocopper(III)-hydroxide complex
Patrick J Donoghue, Jacqui Tehranchi, Christopher J Cramer, et al.
Angewandte Chemie (International Ed. in English)
|
May 26, 2005
Structures of nonheme oxoiron(IV) complexes from X-ray crystallography, NMR spectroscopy, and DFT calculations
Eric J Klinker, József Kaizer, William W Brennessel, et al.
Dalton Transactions (Cambridge, England : 2003)
|
October 19, 2006
Electronic tuning of beta-diketiminate ligands with fluorinated substituents: effects on the O2-reactivity of mononuclear Cu(I) complexes
Lyndal M R Hill, Benjamin F Gherman, Nermeen W Aboelella, et al.
Journal of Chemical Theory and Computation
|
August 19, 2020
First Principles Nonadiabatic Excited-State Molecular Dynamics in NWChem
Huajing Song, Sean A Fischer, Yu Zhang, et al.
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Search research articles
Search
Showing results (151-160 of 271) with videos related to
Sort By:
Page
of 28
Journal of the American Chemical Society
|
February 21, 2018
Structure and Dynamics of Zr<sub>6</sub>O<sub>8</sub> Metal-Organic Framework Node Surfaces Probed with Ethanol Dehydration as a Catalytic Test Reaction
Dong Yang, Manuel A Ortuño, Varinia Bernales, et al.
Science (New York, N.Y.)
|
February 2, 2002
A carbon-free sandwich complex [(P5)2Ti]2-
Eugenijus Urnius, William W Brennessel, Christopher J Cramer, et al.
Journal of Chemical Theory and Computation
|
November 20, 2015
Ab Initio Extension of the AMOEBA Polarizable Force Field to Fe(2.)
David Semrouni, William C Isley, Carine Clavaguéra, et al.
Inorganic Chemistry
|
November 12, 2019
Carboxylate Structural Effects on the Properties and Proton-Coupled Electron Transfer Reactivity of [CuO<sub>2</sub>CR]<sup>2+</sup> Cores
Courtney E Elwell, Mukunda Mandal, Caitlin J Bouchey, et al.
Journal of the American Chemical Society
|
November 18, 2015
Length-Dependent Nanotransport and Charge Hopping Bottlenecks in Long Thiophene-Containing π-Conjugated Molecular Wires
Christopher E Smith, Samuel O Odoh, Soumen Ghosh, et al.
Angewandte Chemie (International Ed. in English)
|
December 18, 2018
Facile Conversion of syn-[Fe<sup>IV</sup> (O)(TMC)]<sup>2+</sup> into the anti Isomer via Meunier's Oxo-Hydroxo Tautomerism Mechanism
Jai Prakash, Yuan Sheng, Apparao Draksharapu, et al.
Journal of the American Chemical Society
|
October 19, 2011
Rapid C-H bond activation by a monocopper(III)-hydroxide complex
Patrick J Donoghue, Jacqui Tehranchi, Christopher J Cramer, et al.
Angewandte Chemie (International Ed. in English)
|
May 26, 2005
Structures of nonheme oxoiron(IV) complexes from X-ray crystallography, NMR spectroscopy, and DFT calculations
Eric J Klinker, József Kaizer, William W Brennessel, et al.
Dalton Transactions (Cambridge, England : 2003)
|
October 19, 2006
Electronic tuning of beta-diketiminate ligands with fluorinated substituents: effects on the O2-reactivity of mononuclear Cu(I) complexes
Lyndal M R Hill, Benjamin F Gherman, Nermeen W Aboelella, et al.
Journal of Chemical Theory and Computation
|
August 19, 2020
First Principles Nonadiabatic Excited-State Molecular Dynamics in NWChem
Huajing Song, Sean A Fischer, Yu Zhang, et al.
Page
of 28