Showing results 34 to 53 of 108
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| Issue Date | Title | Author(s) |
| 2019-01-01 | Decomposition of Ferrocene on Pt(111) and Its Effect on Molecular Electronic Junctions | Reimers, JR; Wang, Y; Kosov, DS |
| 2018-02-01 | Defect states in hexagonal boron nitride: Assignments of observed properties and prediction of properties relevant to quantum computation | Sajid, A; Reimers, JR; Ford, MJ |
| 2011-01-14 | Demonstration and interpretation of significant asymmetry in the low-resolution and high-resolution Q<inf>y</inf> fluorescence and absorption spectra of bacteriochlorophyll a | Rätsep, M; Cai, ZL; Reimers, JR; Freiberg, A |
| 2022-12-31 | Density functionals with asymptotic-potential corrections are required for the simulation of spectroscopic properties of materials | Li, M; Kobayashi, R; Amos, RD; Ford, MJ; Reimers, JR |
| 2017-05-19 | Diabatic models with transferrable parameters for generalized chemical reactions | Reimers, JR; McKemmish, LK; McKenzie, RH; Hush, NS |
| 2017-10-19 | Dipole Order in Halide Perovskites: Polarization and Rashba Band Splittings | Hu, S; Gao, H; Qi, Y; Tao, Y; Li, Y; Reimers, JR; Bokdam, M; Franchini, C; Di Sante, D; Stroppa, A; Ren, W |
| 2013-07-09 | Efficient methods for the quantum chemical treatment of protein structures: The effects of London-dispersion and basis-set incompleteness on peptide and water-cluster geometries | Goerigk, L; Reimers, JR |
| 2015-07-03 | Electron-vibration entanglement in the Born-Oppenheimer description of chemical reactions and spectroscopy | McKemmish, LK; McKenzie, RH; Hush, NS; Reimers, JR |
| 2016-06-27 | En ny historie om guld og svovl | Reimers, JR; Chi, Q; Ford, MJ; Halder, A; Hush, NS; Ulstrup, J; Zhang, J |
| 2018-11-14 | Energy flow in the Photosystem I supercomplex: Comparison of approximative theories with DM-HEOM | Kramer, T; Noack, M; Reimers, JR; Reinefeld, A; Rodríguez, M; Yin, S |
| 2017-01-01 | Erratum: Competition of van der Waals and chemical forces on gold-sulfur surfaces and nanoparticles (Nature Reviews Chemistry (2017) 1 (17) DOI: 10.1038/s41570-017-0017) | Reimers, JR; Ford, MJ; Marcuccio, SM; Ulstrup, J; Hush, NS |
| 2009-03-04 | Evanescent-field spectroscopy using structured optical fibers: Detection of charge-transfer at the porphyrin-silica interface | Martelli, C; Canning, J; Reimers, JR; Sintic, M; Stocks, D; Khoury, T; Crossley, MJ |
| 2018-10-30 | Faraday cage screening reveals intrinsic aspects of the van der Waals attraction | Li, M; Reimers, JR; Dobson, JF; Gould, T |
| 2012-01-01 | First steps towards quantum refinement of protein X-ray structures | Goerigk, L; Falklöf, O; Collyer, CA; Reimers, JR |
| 2014-02-14 | Formation of water-chlorophyll clusters in dilute samples of chlorophyll-a in ether at low temperature | Reimers, JR; Cai, ZL; Kobayashi, R; Rätsep, M; Freiberg, A; Krausz, E |
| 2015-01-01 | Free energies for the coordination of ligands to the magnesium of chlorophyll-a in solvents | Kobayashi, R; Reimers, JR |
| 2012-06-05 | Frequency-based quantum computers from a Chemist's perspective | McKemmish, LK; Kedziora, DJ; White, GR; Hush, NS; Reimers, JR |
| 2016-01-28 | From chaos to order: Chain-length dependence of the free energy of formation of meso-tetraalkylporphyrin self-assembled monolayer polymorphs | Reimers, JR; Panduwinata, D; Visser, J; Chin, Y; Tang, C; Goerigk, L; Ford, MJ; Baker, M; Sum, TJ; Coenen, MJJ; Hendriksen, BLM; Elemans, JAAW; Hush, NS; Crossley, MJ |
| 2011-06-02 | Gold mining by alkanethiol radicals: Vacancies and pits in the self-assembled monolayers of 1-propanethiol and 1-butanethiol on Au(111) | Wang, Y; Chi, Q; Hush, NS; Reimers, JR; Zhang, J; Ulstrup, J |
| 2016-03-15 | Gold surfaces and nanoparticles are protected by Au(0)-thiyl species and are destroyed when Au(I)-thiolates form | Reimers, JR; Ford, MJ; Halder, A; Ulstrup, J; Hush, NS |
