Publications

Showing entries 141 - 160 out of 1283

2023

Conditioning Boltzmann generators for rare event sampling. / Falkner, Sebastian; Coretti, Alessandro; Romano, Salvatore et al.
In: Machine Learning: Science and Technology, Vol. 4, No. 3, 035050, 09.2023.

Publications: Contribution to journal › Article › Peer Reviewed

Do we need delocalised wavefunctions for the excited state dynamics of 1,1-difluoroethylene? / Gomez Rodriguez, Sandra (Corresponding author); Singer, Nadja Katharina; Gonzalez, Leticia et al.
In: Canadian Journal of Chemistry, Vol. 101, No. 9, 09.2023, p. 745-757.

Publications: Contribution to journal › Article › Peer Reviewed

Band-gap trend of corundum oxides α - M2O3 (M = Co, Rh, Ir): An ab initio study. / Cai, Xuefen; Wei, Su Huai (Corresponding author); Deák, Peter et al.
In: Physical Review B, Vol. 108, No. 7, 075137, 15.08.2023.

Publications: Contribution to journal › Article › Peer Reviewed

Stockmayer supracolloidal magnetic polymers under the influence of an applied magnetic field and a shear flow. / Novikau, Ivan S.; Zverev, Vladimir V.; Novak, Ekaterina V. (Corresponding author) et al.
In: Journal of Molecular Liquids, Vol. 384, 122229, 15.08.2023.

Publications: Contribution to journal › Article › Peer Reviewed

Effective Interactions between Double-Stranded DNA Molecules in Aqueous Electrolyte Solutions: Effects of Molecular Architecture and Counterion Valency. / Alexiou, Terpsichori S.; Likos, Christos N. (Corresponding author).
In: Journal of Physical Chemistry B, Vol. 127, No. 31, 10.08.2023, p. 6969-6981.

Publications: Contribution to journal › Article › Peer Reviewed

Benchmark Phaseless Auxiliary-Field Quantum Monte Carlo Method for Small Molecules: Journal of Chemical Theory and Computation. / Sukurma, Zoran (Corresponding author); Schlipf, Martin (Corresponding author); Humer, Moritz (Corresponding author) et al.
In: Journal of Chemical Theory and Computation, Vol. 19, No. 15, 08.08.2023, p. 4921–4934.

Publications: Contribution to journal › Article › Peer Reviewed

Where porous polymers can make a difference. / Woodward, Robert T.; Bismarck, Alexander.
In: Express Polymer Letters, Vol. 17, No. 8, 01.08.2023, p. 771-772.

Publications: Contribution to journal › Editorial › Peer Reviewed

Effects of charge doping on Mott insulator with strong spin-orbit coupling, Ba2Na1−xCaxOsO6. / Cong, Rong; Garcia, Erick; Forino, Paola C. et al.
In: Physical Review Materials, Vol. 7, No. 8, 084409, 08.2023.

Publications: Contribution to journal › Article › Peer Reviewed

Multi-Watt cavity for 266 nm light in vacuum. / Brand, Christian (Corresponding author); Knobloch, Christian; Simonović, Ksenija et al.
In: Physica Scripta, Vol. 98, No. 8, 085521, 08.2023.

Publications: Contribution to journal › Article › Peer Reviewed

Novel fluorescent probes for imaging the serotonin transporter. / Belleza, Oliver John; Saridakis, Iakovos; Lemmerer, Miran et al.
In: Journal of Neurochemistry, Vol. 166, No. Supplement1, Meeting Abstract: A 14-01, 08.2023, p. 84-85.

Publications: Contribution to journal › Meeting abstract/Conference paper › Peer Reviewed

Insights into the material properties of dragline spider silk affecting Schwann cell migration. / Naghilou, Aida (Corresponding author); Peter, Karolina; Millesi, Flavia et al.
In: International Journal of Biological Macromolecules, Vol. 244, 125398, 31.07.2023.

Publications: Contribution to journal › Article › Peer Reviewed

Phaseless auxiliary field quantum Monte Carlo with projector-augmented wave method for solids. / Taheridehkordi, Amir (Corresponding author); Schlipf, Martin; Sukurma, Zoran et al.
In: Journal of Chemical Physics, Vol. 159, No. 4, 044109, 28.07.2023.

Publications: Contribution to journal › Article › Peer Reviewed

Single Heteroatom Configurations in Graphene and Diamond. / Trentino, A.; Zagler, G.; Längle, M. et al.
In: Microscopy and Microanalysis, Vol. 29, No. Suppl. 1, 22.07.2023, p. 1364.

Publications: Contribution to journal › Meeting abstract/Conference paper › Peer Reviewed

Kinetically limited valence of colloidal particles with surface mobile DNA linkers. / Sánchez, Pedro A. (Corresponding author); Caciagli, Alessio; Kantorovich, Sofia et al.
In: Journal of Molecular Liquids, Vol. 382, 121895, 15.07.2023.

Publications: Contribution to journal › Article › Peer Reviewed

Role of ionic surfactant in magnetic dynamics of self-assembled dispersions of nanoplatelets. / Nádasi, Hajnalka (Corresponding author); Küster, Melvin; Mertelj, Alenka et al.
In: Journal of Molecular Liquids, Vol. 382, 121900, 15.07.2023.

Publications: Contribution to journal › Article › Peer Reviewed

Correct specific retention volume determination in inverse gas chromatography. / Kondor, Anett (Corresponding author); Burnett, Daniel J.; Bismarck, Alexander et al.
In: Journal of Chromatography A, Vol. 1700, 464009, 05.07.2023.

Publications: Contribution to journal › Article › Peer Reviewed

Ultrathin membranes composed of branched polyethylenimine and poly[(o-cresyl glycidyl ether)-co-formaldehyde] for primary recovery of itaconic acid. / Santos, Mafalda S.; Schuster, Christian; Rennhofer, Harald et al.
In: Separation and Purification Technology, Vol. 316, 123738, 01.07.2023.

Publications: Contribution to journal › Article › Peer Reviewed

Insights from a laboratory fire. / Jones, Mitchell P.; Weiland, Kathrin; Mitterer, Claudia et al.
In: Nature Chemistry, Vol. 15, No. 7, 07.2023, p. 885-889.

Publications: Contribution to journal › Editorial › Peer Reviewed

Small Polaron Formation on the Nb-doped SrTiO3(001) Surface. / Ellinger, Florian; Shafiq, Muhammad; Ahmad, Iftikhar et al.
In: Physical Review Materials, Vol. 7, 064602, 28.06.2023.

Publications: Contribution to journal › Article › Peer Reviewed

Multicore-based ferrofluids in zero field: initial magnetic susceptibility and self-assembly mechanisms. / Kuznetsov, Andrey A. (Corresponding author); Novak, Ekaterina V.; Pyanzina, Elena S. et al.
In: Soft Matter, Vol. 19, No. 24, 07.06.2023, p. 4549-4561.

Publications: Contribution to journal › Article › Peer Reviewed

Showing entries 141 - 160 out of 1283