Author/Creator: De Proft, Frank - British Library Electronic Legal Deposit Catalogue-Journal Issues and Articles Search Results

Author/Creator De Proft, Frank

1. A Benchmark of Density Functional Approximations For Thermochemistry and Kinetics of Hydride Reductions of Cyclohexanones. Issue 6 (26th June 2019)

Authors:: Deraet, Xavier; Woller, Tatiana; Van Lommel, Ruben; De Proft, Frank; Verniest, Guido; Alonso, Mercedes
Journal:: ChemistryOpen
Issue:: Volume 8:Issue 6(2019)
Page Start:: 788
Record Type:: Journal Article
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2. Back Cover: Integrating 31P DOSY NMR Spectroscopy and Molecular Mechanics as a Powerful Tool for Unraveling the Chemical Structures of Polyoxomolybdate‐Based Amphiphilic Nanohybrids in Aqueous Solution (Chem. Eur. J. 18/2014). Issue 18 (25th April 2014)

Authors:: Shestakova , Pavletta; Absillis, Gregory; Martin‐Martinez, Francisco J.; De Proft, Frank; Willem, Rudolph; Parac‐Vogt, Tatjana N.
Journal:: Chemistry
Issue:: Volume 20:Issue 18(2014)
Page Start:: 5512
Record Type:: Journal Article
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3. Bonding in Heavier Group 14 Zero‐Valent Complexes—A Combined Maximum Probability Domain and Valence Bond Theory Approach. Issue 58 (18th September 2017)

Authors:: Turek, Jan; Braïda, Benoît; De Proft, Frank
Journal:: Chemistry
Issue:: Volume 23:Issue 58(2017)
Page Start:: 14604
Record Type:: Journal Article
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4. Conceptual Insights into DFT Spin‐State Energetics of Octahedral Transition‐Metal Complexes through a Density Difference Analysis. Issue 20 (27th December 2017)

Authors:: Pinter, Balazs; Chankisjijev, Artiom; Geerlings, Paul; Harvey, Jeremy N.; De Proft, Frank
Journal:: Chemistry
Issue:: Volume 24:Issue 20(2018)
Page Start:: 5281
Record Type:: Journal Article
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5. Conceptual Quantum Chemical Analysis of Bonding and Noncovalent Interactions in the Formation of Frustrated Lewis Pairs. Issue 14 (18th February 2015)

Authors:: Skara, Gabriella; Pinter, Balazs; Top, Jens; Geerlings, Paul; De Proft, Frank; De Vleeschouwer, Freija
Journal:: Chemistry
Issue:: Volume 21:Issue 14(2015)
Page Start:: 5510
Record Type:: Journal Article
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6. Cover Picture: Metalated Hexaphyrins: From Understanding to Rational Design (Chem. Eur. J. 49/2015). Issue 49 (1st December 2015)

Authors:: Alonso, Mercedes; Pinter, Balazs; Geerlings, Paul; De Proft, Frank
Journal:: Chemistry
Issue:: Volume 21:Issue 49(2015)
Page Start:: 17521
Record Type:: Journal Article
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7. Cover Picture: Molecular Property Optimizations with Boundary Conditions through the Best First Search Scheme (ChemPhysChem 10/2016). Issue 10 (4th May 2016)

Authors:: De Vleeschouwer, Freija; Geerlings, Paul; De Proft, Frank
Journal:: Chemphyschem
Issue:: Volume 17:Issue 10(2016)
Page Start:: 1389
Record Type:: Journal Article
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8. Cover Picture: Understanding the Fundamental Role of π/π, σ/σ, and σ/π Dispersion Interactions in Shaping Carbon‐Based Materials (Chem. Eur. J. 17/2014). Issue 17 (22nd April 2014)

Authors:: Alonso, Mercedes; Woller, Tatiana; Martín‐Martínez, Francisco J.; Contreras‐García, Julia; Geerlings, Paul; De Proft, Frank
Journal:: Chemistry
Issue:: Volume 20:Issue 17(2014)
Page Start:: 4841
Record Type:: Journal Article
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9. Dimers of N‐Heterocyclic Carbene Copper, Silver, and Gold Halides: Probing Metallophilic Interactions through Electron Density Based Concepts. Issue 3 (11th December 2013)

Authors:: Pinter, Balazs; Broeckaert, Lies; Turek, Jan; Růžička, Aleš; De Proft, Frank
Journal:: Chemistry
Issue:: Volume 20:Issue 3(2014)
Page Start:: 734
Record Type:: Journal Article
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10. Electron Capture by the Thiyl Radical and Disulfide Bond: Ligand Effects on the Reduction Potential. Issue 16 (20th February 2013)

Authors:: Roos, Goedele; De Proft, Frank; Geerlings, Paul
Journal:: Chemistry
Issue:: Volume 19:Issue 16(2013)
Page Start:: 5050
Record Type:: Journal Article
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