Publications of Giovanni Bistoni
All genres
Journal Article (63)
2018
Journal Article
Lu, Q.; Neese, F.; Bistoni, G. Formation of Agostic Structures Driven by London Dispersion. Angewandte Chemie International Edition 2018, 57, 4760–4764.
Journal Article
Auer, A. A.; ; ; Bistoni, G.; ; ; ; ; ; ; ; ; ; ; ; ; ; ; Neese, F.; ; ; ; The Furan Microsolvation Blind Challenge for Quantum Chemical Methods: First Steps. The Journal of Chemical Physics 2018, 148, 014301.
; ; ; ; ; 2017
Journal Article
Auer, A. A.; Bistoni, G.; ; ; ; Electronic Structure Calculations and Experimental Studies on the Thermal Initiation of the Twin Polymerization Process. ChemPlusChem 2017, 82, 1396–1407.
Journal Article
Bistoni, G.; Riplinger, C.; ; ; Auer, A. A.; Neese, F. Treating Subvalence Correlation Effects in Domain Based Pair Natural Orbital Coupled Cluster Calculations: An Out-of-the-Box Approach. Journal of Chemical Theory and Computation 2017, 13, 3220–3227.
Journal Article
Bistoni, G.; ; ; ; Modulating the Bonding Properties of N‐Heterocyclic Carbenes (NHCs): A Systematic Charge‐Displacement Analysis. Chemistry – A European Journal 2017, 23, 7558–7569.
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Bistoni, G.; Riplinger, C.; Auer, A. A.; Neese, F.; Pair Natural Orbital and Canonical Coupled Cluster Reaction Enthalpies Involving Light to Heavy Alkali and Alkaline Earth Metals: the Importance of Sub-Valence Correlation. Physical Chemistry Chemical Physics 2017, 19, 9374–9391.
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Journal Article
Bistoni, G.; ; ; ; ; 13C NMR Spectroscopy of N‐Heterocyclic Carbenes Can Selectively Probe σ Donation in Gold(I) Complexes. Chemistry – A European Journal 2017, 23, 2722–2728.
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Bistoni, G.; Auer, A. A.; Neese, F. Understanding the Role of Dispersion in Frustrated Lewis Pairs and Classical Lewis Adducts: A Domain‐Based Local Pair Natural Orbital Coupled Cluster Study. Chemistry – A European Journal 2017, 23, 865–873.
2016
Journal Article
Schneider, W. B.; Bistoni, G.; Sparta, M.; Saitow, M.; Riplinger, C.; Auer, A. A.; Neese, F. Decomposition of Intermolecular Interaction Energies Within the Local Pair Natural Orbital Coupled Cluster Framework. Journal of Chemical Theory and Computation 2016, 12, 4778–4792.
Journal Article
Bistoni, G.; ; ; π Activation of Alkynes in Homogeneous and Heterogeneous Gold Catalysis. The Journal of Physical Chemistry A 2016, 120, 5239–5247.
Journal Article
Bistoni, G.; ; ; Strong Electron-Donating Ligands Accelerate the Protodeauration Step in Gold(I)-Catalyzed Reactions: A Quantitative Understanding of the Ligand Effect. Organometallics 2016, 35, 2275–2285.
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Bistoni, G.; ; Advances in Charge Displacement Analysis. Journal of Chemical Theory and Computation 2016, 12, 1236–1244.
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Bistoni, G.; ; ; ; ; ; How π Back-Donation Quantitatively Controls the CO Stretching Response in Classical and non-Classical Metal Carbonyl Complexes. Chemical Science 2016, 7, 1174–1184.
2015
Journal Article
Bistoni, G.; ; ; ; Quantitative Assessment of the Carbocation/Carbene Character of the Gold–Carbene Bond. Dalton Transactions 2015, 44, 13999–14007.
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Journal Article
Bistoni, G.; ; ; ; Anomalous Ligand Effect in Gold(I)-Catalyzed Intramolecular Hydroamination of Alkynes. Chemical Communications 2015, 51, 5990–5993.
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Bistoni, G.; ; ; Relationship between the Anion/Cation Relative Orientation and the Catalytic Activity of Nitrogen Acyclic Carbene–Gold Catalysts. Catalysis Science & Technology 2015, 5, 1558–1567.
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Bistoni, G.; ; ; Charge-Displacement Analysis Via Natural Orbitals for Chemical Valence: Charge Transfer Effects in Coordination Chemistry. The Journal of Chemical Physics 2015, 142, 084112.
Journal Article
Bistoni, G.; ; ; ; Selectively Measuring π Back‐Donation in Gold(I) Complexes by NMR Spectroscopy. Chemistry – A European Journal 2015, 21, 2467–2473.
; ; 2014
Journal Article
Bistoni, G.; ; ; ; When the Tolman Electronic Parameter Fails: A Comparative DFT and Charge Displacement Study of [(L)Ni(CO)3]0/– and [(L)Au(CO)]0/+. Inorganic Chemistry 2014, 53, 9907–9916.
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Journal Article
Bistoni, G.; ; ; The Chemical Bond in Gold(I) Complexes with N-Heterocyclic Carbenes. Organometallics 2014, 33, 4200–4208.
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