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All papers authored by Jan M. L. Martin

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2020 Nitai Sylvetsky, Ambar Banerjee

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, Mercedes Alonso

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, Jan M. L. Martin

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Performance of Localized Coupled Cluster Methods in a Moderately Strong Correlation Regime: Hückel–Möbius Interconversions in Expanded Porphyrins

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F. de Proft, Tatiana Woller, Ambar Banerjee

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, Nitai Sylvetsky, Golokesh Santra

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, Xavier Deraet

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, Frank De Proft, Gershom Martin, Jan M. L. Martin

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, Mercedes Alonso

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Performance of Electronic Structure Methods for the Description of Hückel–Möbius Interconversions in Extended π-Systems

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2018 Eynat Haviv, Dima Azaiza-Dabbah, Raanan Carmieli, Liat Avram

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, Jan M. L. Martin

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, Ronny Neumann

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A Thiourea Tether in the Second Coordination Sphere as a Binding Site for CO2 and a Proton Donor Promotes the Electrochemical Reduction of CO2 to CO Catalyzed by a Rhenium Bipyridine Type Complex

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Alexander M. Khenkin, Irena Efremenko, Jan M. L. Martin

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, Ronny Neumann

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The kinetics and mechanism of oxidation of reduced phosphovanadomolybdates by molecular oxygen: theory and experiment in concert

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2017 Nitai Sylvetsky, Manoj K. Kesharwani, Jan M. L. Martin

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The aug-cc-pVnZ-F12 basis set family: Correlation consistent basis sets for explicitly correlated benchmark calculations on anions and noncovalent complexes

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2016 Nitai Sylvetsky, Kirk A. Peterson

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, Jan M. L. Martin

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Toward a W4-F12 approach: Can explicitly correlated and orbital-based ab initio CCSD(T) limits be reconciled?

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2015 Manoj Kumar Kesharwani, Sebastian Kozuch, Jan M. L. Martin

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Comment on: Doubly hybrid density functional xDH-PBE0 from a parameter-free global hybrid model PBE0 (J. Chem. Phys. 136, 174103 (2012))

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