Browsing byAuthorReimers, JR

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Issue DateTitleAuthor(s)
2019-10-28Absorption-emission symmetry breaking and the different origins of vibrational structures of the 1Qy and 1Qx electronic transitions of pheophytin aRätsep, M; Linnanto, JM; Muru, R; Biczysko, M; Reimers, JR; Freiberg, A
2010-05-26Accurate and computationally efficient third-nearest-neighbor tight-binding model for large graphene fragmentsWohlthat, S; Reimers, JR; Hush, NS
2021-05-19Accurate prediction of the properties of materials using the CAM‐B3LYP density functionalLi, M; Reimers, JR; Ford, MJ; Kobayashi, R; Amos, RD
2006-12-01Adsorption of benzene on copper, silver, and gold surfacesBilić, A; Reimers, JR; Hush, NS; Hoft, RC; Ford, MJ
2014-02-14An analytical data inversion method for magnetic circular dichroism spectra dominated by the "b-term"Reimers, JR; Krausz, E
2013-10-14Assignment of the Q-Bands of the Chlorophylls: Coherence Loss via Q x-Q y MixingReimers, JR; Cai, ZL; Kobayashi, R; Rätsep, M; Freiberg, A; Krausz, E
2020-01Asymmetry in the Qy Fluorescence and Absorption Spectra of Chlorophyll <i>a</i> Pertaining to Exciton Dynamics.Reimers, JR; Rätsep, M; Freiberg, A
2011-01-20Atomic-resolution kinked structure of an alkylporphyrin on highly ordered pyrolytic graphiteChin, Y; Panduwinata, D; Sintic, M; Sum, TJ; Hush, NS; Crossley, MJ; Reimers, JR
2019-03-21Bioferroelectric Properties of Glycine CrystalsHu, P; Hu, S; Huang, Y; Reimers, JR; Rappe, AM; Li, Y; Stroppa, A; Ren, W
2015-07-02Bond angle variations in XH<inf>3</inf> [X = N, P, As, Sb, Bi]: The critical role of Rydberg orbitals exposed using a diabatic state modelReimers, JR; McKemmish, LK; McKenzie, RH; Hush, NS
2011-09-28Chain-branching control of the atomic structure of alkanethiol-based gold-sulfur interfacesWang, Y; Chi, Q; Zhang, J; Hush, NS; Reimers, JR; Ulstrup, J
2016-09-01Challenges facing an understanding of the nature of low-energy excited states in photosynthesisReimers, JR; Biczysko, M; Bruce, D; Coker, DF; Frankcombe, TJ; Hashimoto, H; Hauer, J; Jankowiak, R; Kramer, T; Linnanto, J; Mamedov, F; Müh, F; Rätsep, M; Renger, T; Styring, S; Wan, J; Wang, Z; Wang-Otomo, ZY; Weng, YX; Yang, C; Zhang, JP; Freiberg, A; Krausz, E
2012-07-19Challenges for the accurate simulation of anisotropic charge mobilities through organic molecular crystals: The β phase of mer-tris(8- hydroxyquinolinato)aluminum(III) (Alq3) crystalYin, S; Li, L; Yang, Y; Reimers, JR
2017-01-01Chapter 13 Surface AdsorptionReimers, JR; Li, M; Wan, D; Gould, T; Ford, MJ
2010-06-23Chemical analysis of the superatom model for sulfur-stabilized gold nanoparticlesReimers, JR; Wang, Y; Cankurtaran, BO; Ford, MJ
2022-01-01Chlorophyll spectroscopy: Conceptual basis, modern high-resolution approaches, and current challengesReimers, JR; Rätsep, M; Linnanto, JM; Freiberg, A
2019-09-28Competition between charge migration and charge transfer induced by nuclear motion following core ionization: Model systems and application to Li<inf>2</inf><sup>+</sup>Yang, L; Reimers, JR; Kobayashi, R; Hush, NS
2017-01-11Competition of van der Waals and chemical forces on gold-sulfur surfaces and nanoparticlesReimers, JR; Ford, MJ; Marcuccio, SM; Ulstrup, J; Hush, NS
2017-01-01Competition of van der waals and chemical forces on gold–sulfur surfaces and nanoparticlesReimers, JR; Ford, MJ; Marcuccio, SM; Ulstrup, J; Hush, NS
2011-02-21Complexation, computational, magnetic, and structural studies of the maillard reaction product isomaltol including investigation of an uncommon π interaction with copper(II)Heine, KB; Clegg, JK; Heine, A; Gloe, K; Henle, T; Bernhard, G; Cai, ZL; Reimers, JR; Lindoy, LF; Lach, J; Kersting, B