Recent changes for /fac/sci/chemistry/research/maurer/maurergroup/

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Computational Surface Science; Maurer Group

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Reinhard Maurer — Thu, 21 Mar 2019 11:31:15 GMT

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Computational design of metal-supported molecular switches: Transient ion formation during light- and electron-induced isomerisation of azobenzene

Reinhard Maurer — Mon, 19 Nov 2018 09:18:49 GMT

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Hot-electron effects during reactive scattering of H2 from Ag(111): the interplay between mode-specific electronic friction and the potential energy landscape

Reinhard Maurer — Sun, 11 Nov 2018 13:26:21 GMT

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SCRTP Jupyter Service

Reinhard Maurer — Fri, 09 Nov 2018 21:56:41 GMT

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Up, Down, or Both? You'll find the answer in our new paper in J. Phys. Chem. C.

Reinhard Maurer — Tue, 23 Oct 2018 11:20:41 GMT

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The Structure of VOPc on Cu(111): Does V═O Point Up, or Down, or Both?

Reinhard Maurer — Tue, 23 Oct 2018 11:10:45 GMT

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ΔSCF-DFT and MolPDOS in CASTEP

Reinhard Maurer — Mon, 03 Sep 2018 12:10:38 GMT

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winak: Global optimization and materials structure search

Reinhard Maurer — Fri, 31 Aug 2018 16:54:57 GMT

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Tracking Metal Electrodeposition Dynamics from Nucleation and Growth of a Single Atom to Crystalline Nanoparticle

Reinhard Maurer — Mon, 13 Aug 2018 14:39:02 GMT

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Structure and Stability of Molecular Crystals with Many Body Dispersion Inclusive Density Functional Tight Binding

Reinhard Maurer — Mon, 11 Jun 2018 21:39:40 GMT

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Electron-Hole-Pair-Induced Vibrational Energy Relaxation of Rhenium Catalysts on Gold Surfaces

Reinhard Maurer — Mon, 11 Jun 2018 21:37:21 GMT

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Mode specific electronic friction in dissociative chemisorption on metal surfaces: H2 on Ag(111)

Reinhard Maurer — Mon, 11 Dec 2017 21:11:02 GMT

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Interpretation of X-ray Absorption Spectroscopy in the Presence of Surface Hybridisation

Reinhard Maurer — Wed, 18 Oct 2017 18:33:19 GMT

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Ab-initio tensorial electronic friction for molecules on metal surfaces: nonadiabatic vibrational relaxation

Reinhard Maurer — Wed, 18 Oct 2017 18:26:32 GMT

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Global structure search for molecules on surfaces: Efficient sampling with curvilinear coordinates

Reinhard Maurer — Tue, 17 Oct 2017 21:08:56 GMT

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Switching of an Azobenzene-Tripod Molecule on Ag(111)

Reinhard Maurer — Tue, 17 Oct 2017 21:03:05 GMT

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Adsorption structures and energetics of molecules on metal surfaces: Bridging experiment and theory

Reinhard Maurer — Tue, 17 Oct 2017 20:55:52 GMT

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Role of Tensorial Electronic Friction in Energy Transfer at Metal Surfaces

Reinhard Maurer — Tue, 17 Oct 2017 20:50:48 GMT

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