Andreas Hansen
Overview
Explore the profile of Andreas Hansen including associated specialties, affiliations and a list of published articles.
Author names and details appear as published. Due to indexing inconsistencies, multiple individuals may share a name, and a single author may have variations. MedLuna displays this data as publicly available, without modification or verification
Snapshot
Snapshot
Articles
84
Citations
2202
Followers
0
Related Specialties
Related Specialties
Top 10 Co-Authors
Top 10 Co-Authors
Published In
Published In
Affiliations
Affiliations
Soon will be listed here.
Recent Articles
1.
Kunze L, Hansen A, Grimme S, Mewes J
J Phys Chem Lett
. 2025 Jan;
16(4):1114-1125.
PMID: 39846377
With their narrow-band emission, high quantum yield, and good chemical stability, multiresonance thermally activated delayed fluorescence (MR-TADF) emitters are promising materials for OLED technology. However, accurately modeling key properties, such...
2.
Werner H, Hansen A
J Phys Chem A
. 2024 Dec;
128(50):10936-10947.
PMID: 39637318
Many chemical reactions affect only a rather small number of bonds, leaving the largest part of the chemical and geometrical structure of the molecules nearly unchanged. In this work we...
3.
Muller M, Froitzheim T, Hansen A, Grimme S
J Phys Chem A
. 2024 Dec;
128(49):10723-10736.
PMID: 39621818
The Charge Extended Hückel (CEH) model, initially introduced for adaptive atomic orbital (AO) basis set construction ( , 159, 164108), has been significantly revised to enhance accuracy and robustness, particularly...
4.
Plett C, Grimme S, Hansen A
J Chem Theory Comput
. 2024 Sep;
PMID: 39259679
Simulating peptides and proteins is becoming increasingly important, leading to a growing need for efficient computational methods. These are typically semiempirical quantum mechanical (SQM) methods, force fields (FFs), or machine-learned...
5.
Kramer P, Kohn J, Hofmeister D, Kersten M, Sterzenbach C, Gres A, et al.
Angew Chem Int Ed Engl
. 2024 Aug;
63(46):e202411092.
PMID: 39109443
A lateral expansion of molecular spoked wheels (MSWs) based on an all-phenylene backbone is described. The MSWs contain a central hub, six spokes, and a rim that is formed by...
6.
Wittmann L, Gordiy I, Friede M, Helmich-Paris B, Grimme S, Hansen A, et al.
Phys Chem Chem Phys
. 2024 Aug;
26(32):21379-21394.
PMID: 39092890
Efficient dispersion corrections are an indispensable component of modern density functional theory, semi-empirical quantum mechanical, and even force field methods. In this work, we extend the well established D3 and...
7.
Kunze L, Froitzheim T, Hansen A, Grimme S, Mewes J
J Phys Chem Lett
. 2024 Jul;
15(31):8065-8077.
PMID: 39083761
Efficient OLEDs need to quickly convert singlet and triplet excitons into photons. Molecules with an inverted singlet-triplet energy gap (INVEST) are promising candidates for this task. However, typical INVEST molecules...
8.
Karagiannis A, Neugebauer H, Lalancette R, Grimme S, Hansen A, Prokopchuk D
J Am Chem Soc
. 2024 Jul;
146(28):19279-19285.
PMID: 38976843
We report an incredibly reducing and redox-active Mn dianion, [Mn(CO)(PhB(NHC))] (NHC = N-heterocyclic carbene), furnished via 2e reduction of the parent 16e Mn complex with Na or K. Cyclic voltammograms...
9.
Gasevic T, Bursch M, Ma Q, Grimme S, Werner H, Hansen A
Phys Chem Chem Phys
. 2024 Apr;
26(18):13884-13908.
PMID: 38661329
The elements of the p-block of the periodic table are of high interest in various chemical and technical applications like frustrated Lewis-pairs (FLP) or opto-electronics. However, high-quality benchmark data to...
10.
Rickert S, Luo S, Bahr J, Kohn J, Xue M, Hansen A, et al.
J Am Chem Soc
. 2024 Jan;
146(5):2986-2996.
PMID: 38263586
Phenanthracene nanotubes with arylene-ethynylene-butadiynylene rims and phenanthracene walls are synthesized in a modular bottom-up approach. One of the rims carries hexadecyloxy side chains, mediating the affinity to highly oriented pyrolytic...