Showing results 40 to 59 of 108
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| Issue Date | Title | Author(s) |
| 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 |
| 2018-01-09 | How Equilibrium Gets Mimicked during Kinetic and Thermodynamic Control in Porphyrin and Phthalocyanine Self-Assembled Monolayers | Reimers, JR |
| 2012-07-07 | Hydrogen bonding and reactivity of water to azines in their S <inf>1</inf> (n,π*) electronic excited states in the gas phase and in solution | Reimers, JR; Cai, ZL |
| 2020-03-02 | Identifying Carbon as the Source of Visible Single Photon Emission from Hexagonal Boron Nitride | Mendelson, N; Chugh, D; Reimers, JR; Cheng, TS; Gottscholl, A; Long, H; Mellor, CJ; Zettl, A; Dyakonov, V; Beton, PH; Novikov, SV; Jagadish, C; Tan, HH; Ford, MJ; Toth, M; Bradac, C; Aharonovich, I |
| 2021-03 | Identifying carbon as the source of visible single-photon emission from hexagonal boron nitride. | Mendelson, N; Chugh, D; Reimers, JR; Cheng, TS; Gottscholl, A; Long, H; Mellor, CJ; Zettl, A; Dyakonov, V; Beton, PH; Novikov, SV; Jagadish, C; Tan, HH; Ford, MJ; Toth, M; Bradac, C; Aharonovich, I |
| 2011-12-01 | Interference-induced electron- and hole-conduction asymmetry | Wohlthat, S; Solomon, GC; Hush, NS; Reimers, JR |
| 2015-04-07 | Intermixed adatom and surface-bound adsorbates in regular self-assembled monolayers of racemic 2-butanethiol on Au(111) | Ouyang, R; Yan, J; Jensen, PS; Ascic, E; Gan, S; Tanner, D; Mao, B; Niu, L; Zhang, J; Tang, C; Hush, NS; Reimers, JR; Ulstrup, J |
