Kamu erişimi zorunlu olan makaleler - Aliaksandr V. YakutovichDaha fazla bilgi edinin
Bir yerde sunuluyor: 16
Materials Cloud, a platform for open computational science
L Talirz, S Kumbhar, E Passaro, AV Yakutovich, V Granata, F Gargiulo, ...
Scientific data 7 (1), 299, 2020
Zorunlu olanlar: Swiss National Science Foundation, European Commission, Government of Italy
AiiDA 1.0, a scalable computational infrastructure for automated reproducible workflows and data provenance
SP Huber, S Zoupanos, M Uhrin, L Talirz, L Kahle, R Häuselmann, ...
Scientific data 7 (1), 300, 2020
Zorunlu olanlar: Swiss National Science Foundation, European Commission
In silico design of 2D and 3D covalent organic frameworks for methane storage applications
R Mercado, RS Fu, AV Yakutovich, L Talirz, M Haranczyk, B Smit
Chemistry of Materials 30 (15), 5069-5086, 2018
Zorunlu olanlar: US National Science Foundation, US Department of Energy, Swiss National …
Building a consistent and reproducible database for adsorption evaluation in covalent–organic frameworks
D Ongari, AV Yakutovich, L Talirz, B Smit
ACS central science 5 (10), 1663-1675, 2019
Zorunlu olanlar: US Department of Energy, Swiss National Science Foundation, European Commission
On-Surface Synthesis of Antiaromatic and Open-Shell Indeno[2,1-b]fluorene Polymers and Their Lateral Fusion into Porous Ribbons
M Di Giovannantonio, K Eimre, AV Yakutovich, Q Chen, S Mishra, JI Urgel, ...
Journal of the American Chemical Society 141 (31), 12346-12354, 2019
Zorunlu olanlar: Swiss National Science Foundation, US Department of Defense, European Commission
On-surface synthesis of indenofluorene polymers by oxidative five-membered ring formation
M Di Giovannantonio, JI Urgel, U Beser, AV Yakutovich, J Wilhelm, ...
Journal of the American Chemical Society 140 (10), 3532-3536, 2018
Zorunlu olanlar: Swiss National Science Foundation, US Department of Defense, European Commission
AiiDAlab–an ecosystem for developing, executing, and sharing scientific workflows
AV Yakutovich, K Eimre, O Schütt, L Talirz, CS Adorf, CW Andersen, ...
Computational Materials Science 188, 110165, 2021
Zorunlu olanlar: Swiss National Science Foundation, European Commission, Government of Italy
In silico discovery of covalent organic frameworks for carbon capture
KS Deeg, D Damasceno Borges, D Ongari, N Rampal, L Talirz, ...
ACS applied materials & interfaces 12 (19), 21559-21568, 2020
Zorunlu olanlar: US National Science Foundation, US Department of Energy, Swiss National …
How to verify the precision of density-functional-theory implementations via reproducible and universal workflows
E Bosoni, L Beal, M Bercx, P Blaha, S Blügel, J Bröder, M Callsen, ...
Nature Reviews Physics 6 (1), 45-58, 2024
Zorunlu olanlar: Swiss National Science Foundation, Austrian Science Fund, National Fund for …
Common workflows for computing material properties using different quantum engines
SP Huber, E Bosoni, M Bercx, J Bröder, A Degomme, V Dikan, K Eimre, ...
npj Computational Materials 7 (1), 136, 2021
Zorunlu olanlar: US Department of Energy, Swiss National Science Foundation, European …
Hidden beneath the surface: origin of the observed enantioselective adsorption on PdGa (111)
AV Yakutovich, J Hoja, D Passerone, A Tkatchenko, CA Pignedoli
Journal of the American Chemical Society 140 (4), 1401-1408, 2018
Zorunlu olanlar: Swiss National Science Foundation
Tailoring Magnetism of Graphene Nanoflakes via Tip-Controlled Dehydrogenation
C Zhao, Q Huang, L Valenta, K Eimre, L Yang, AV Yakutovich, W Xu, J Ma, ...
Physical review letters 132 (4), 046201, 2024
Zorunlu olanlar: Swiss National Science Foundation, European Commission
Hydrogen bonded trimesic acid networks on Cu (111) reveal how basic chemical properties are imprinted in HR-AFM images
P Zahl, AV Yakutovich, E Ventura-Macías, J Carracedo-Cosme, ...
Nanoscale 13 (44), 18473-18482, 2021
Zorunlu olanlar: US Department of Energy, Government of Spain
Near‐Enantiopure Trimerization of 9‐Ethynylphenanthrene on a Chiral Metal Surface
S Stolz, AV Yakutovich, J Prinz, T Dienel, CA Pignedoli, H Brune, ...
Angewandte Chemie International Edition 59 (41), 18179-18183, 2020
Zorunlu olanlar: US National Science Foundation, Swiss National Science Foundation
Advancing Scanning Probe Microscopy Simulations: A Decade of Development in Probe-Particle Models
N Oinonen, AV Yakutovich, A Gallardo, M Ondráček, P Hapala, O Krejčí
Computer Physics Communications, 109341, 2024
Zorunlu olanlar: Swiss National Science Foundation, Academy of Finland, European Commission
Connecting lab experiments with computer experiments: Making" routine" simulations routine
KM Jablonka, M Zasso, L Patiny, N Marzari, G Pizzi, B Smit, ...
Zorunlu olanlar: Swiss National Science Foundation, European Commission
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