受强制性开放获取政策约束的文章 - Reinhold F. Fink了解详情
无法在其他位置公开访问的文章：24 篇
Exciton trapping in π-conjugated materials: A quantum-chemistry-based protocol applied to perylene bisimide dye aggregates
RF Fink, J Seibt, V Engel, M Renz, M Kaupp, S Lochbrunner, HM Zhao, ...
Journal of the American Chemical Society 130 (39), 12858-12859, 2008
强制性开放获取政策： German Research Foundation
Ultrafast exciton self-trapping upon geometry deformation in perylene-based molecular aggregates
A Schubert, V Settels, W Liu, F Würthner, C Meier, RF Fink, ...
The journal of physical chemistry letters 4 (5), 792-796, 2013
强制性开放获取政策： German Research Foundation
Assessment of TD‐DFT‐and TD‐HF‐based approaches for the prediction of exciton coupling parameters, potential energy curves, and electronic characters of electronically excited …
W Liu, V Settels, PHP Harbach, A Dreuw, RF Fink, B Engels
Journal of Computational Chemistry 32 (9), 1971-1981, 2011
强制性开放获取政策： German Research Foundation
Singlet exciton diffusion in organic crystals based on marcus transfer rates
V Stehr, RF Fink, B Engels, J Pflaum, C Deibel
Journal of Chemical Theory and Computation 10 (3), 1242-1255, 2014
强制性开放获取政策： German Research Foundation
On the origin of the stabilization of the zwitterionic resting state of cysteine proteases: a theoretical study
M Mladenovic, RF Fink, W Thiel, T Schirmeister, B Engels
Journal of the American Chemical Society 130 (27), 8696-8705, 2008
强制性开放获取政策： German Research Foundation
Atomistic insights into the inhibition of cysteine proteases: First QM/MM calculations clarifying the regiospecificity and the inhibition potency of epoxide-and aziridine-based …
M Mladenovic, K Junold, RF Fink, W Thiel, T Schirmeister, B Engels
The Journal of Physical Chemistry B 112 (17), 5458-5469, 2008
强制性开放获取政策： German Research Foundation
Environmental effects on charge densities of biologically active molecules: do molecule crystal environments indeed approximate protein surroundings?
M Mladenovic, M Arnone, RF Fink, B Engels
The Journal of Physical Chemistry B 113 (15), 5072-5082, 2009
强制性开放获取政策： German Research Foundation
Origin of the reactivity differences of substituted aziridines: CN vs CC bond breakages
A Paasche, M Arnone, RF Fink, T Schirmeister, B Engels
The Journal of Organic Chemistry 74 (15), 5244-5249, 2009
强制性开放获取政策： German Research Foundation
Catalytic asymmetric transformations of racemic aziridines
Z Chai
Synthesis 52 (12), 1738-1750, 2020
强制性开放获取政策： 国家自然科学基金委员会
Paracyclophanes as model compounds for strongly interacting π-systems. Part 1. Pseudo-ortho-dihydroxy [2.2] paracyclophane
C Schon, W Roth, I Fischer, J Pfister, C Kaiser, RF Fink, B Engels
Physical Chemistry Chemical Physics 12 (32), 9339-9346, 2010
强制性开放获取政策： German Research Foundation
Geometry relaxation-mediated localization and delocalization of excitons in organic semiconductors: A quantum chemical study
M Deutsch, S Wirsing, D Kaiser, RF Fink, P Tegeder, B Engels
The Journal of Chemical Physics 153 (22), 2020
强制性开放获取政策： German Research Foundation
A facile method for the synthesis of binary tungsten iodides
M Ströbele, C Castro, RF Fink, HJ Meyer
Angewandte Chemie International Edition 55 (15), 4814-4817, 2016
强制性开放获取政策： German Research Foundation
Paracyclophanes as model compounds for strongly interacting π-systems, Part 3: Influence of the substitution pattern on photoabsorption properties
J Pfister, C Schon, W Roth, C Kaiser, C Lambert, K Gruss, ...
The Journal of Physical Chemistry A 115 (15), 3583-3591, 2011
强制性开放获取政策： German Research Foundation
Influence of a polarizable surrounding on the electronically excited states of aggregated perylene materials
D Bellinger, V Settels, W Liu, RF Fink, B Engels
Journal of Computational Chemistry 37 (17), 1601-1610, 2016
强制性开放获取政策： German Research Foundation
From WCl6 to WCl2: Properties of Intermediate Fe–W–Cl Phases
A Mos, C Castro, S Indris, M Ströbele, RF Fink, HJ Meyer
Inorganic Chemistry 54 (20), 9826-9832, 2015
强制性开放获取政策： German Research Foundation
Can Experimental Electron‐Density Studies be Used as a Tool to Predict Biologically Relevant Properties of Low‐Molecular Weight Enzyme Ligands?
S Grabowsky, D Jayatilaka, RF Fink, T Schirmeister, B Engels
Zeitschrift für anorganische und allgemeine Chemie 639 (11), 1905-1921, 2013
强制性开放获取政策： Australian Research Council, German Research Foundation
Charge carrier mobilities in organic semiconductor crystals based on the spectral overlap
V Stehr, RF Fink, C Deibel, B Engels
Journal of Computational Chemistry 37 (23), 2146-2156, 2016
强制性开放获取政策： German Research Foundation
Eine einfache Methode zur Synthese von binären Wolframiodiden
M Ströbele, C Castro, RF Fink, HJ Meyer
Angewandte Chemie 128 (15), 4894-4897, 2016
强制性开放获取政策： German Research Foundation
Isomerization and fragmentation pathways of 1, 2‐azaborine
K Edel, RF Fink, HF Bettinger
Journal of Computational Chemistry 37 (1), 110-116, 2016
强制性开放获取政策： German Research Foundation
UREMP, RO-REMP, and OO-REMP: Hybrid perturbation theories for open-shell electronic structure calculations
S Behnle, RF Fink
The Journal of Chemical Physics 156 (12), 2022
强制性开放获取政策： German Research Foundation
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