Petersen, Amanda S.;Madsen, Thor K.;Sarpey, Theophilus K.;Schott, Christian M.;Gubanova, Elena L.;Himmelreich, Adrian V.;Bandarenka, Aliaksandr S.;Rossmeisl, Jan
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Advanced Theory and Simulations
2025

Kipfer, Tim;Berk, Rafael B.;Riewald, Felix;Piana, Michele;Gasteiger, Hubert A.
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Journal of The Electrochemical Society
2025
172
10
100505

Yu, Haiting;Sechi, Renata;Liao, Qingdian;Stokkebye Nissen, Mathias;Bhowmik, Arghya;Gubanova, Elena L.;Song, Kun‐Ting;Hansen, Heine A.;Bandarenka, Aliaksandr S.
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Advanced Materials Interfaces
2025

Shen, Hengyuan;Bogo, Nicola;Stein, Christopher J.;Head-Gordon, Martin
Understanding Electronic Excitations Between Single Determinants with Occupied-Virtual Orbitals for Chemical Valence
Journal of Chemical Theory and Computation
2025
21
19
9525-9537

Deger, Simon Nicolas;Mauri, Anna;Cui, Yang;Weishäupl, Sebastian Josef;Özdemir, Ali Deniz;Syed, Hamad;Ovsianikov, Aleksandr;Wenzel, Wolfgang;Pöthig, Alexander;Hauer, Jürgen;Kozlowska, Mariana;Fischer, Roland Augustinus
Intermolecular Interactions as Driving Force of Increasing Multiphoton Absorption in a Perylene Diimide‐Based Coordination Polymer
Advanced Functional Materials
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Deger, Simon N.;Pacheco Hernandez, Helmy;Cui, Yang;Hao, Hongxing;Ramm, Vanessa;Mayer, David C.;Truong, Khai‐Nghi;Fischer, Roland A.;Hauer, Jürgen;Kozlowska, Mariana;Pöthig, Alexander
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Advanced Functional Materials
2025

Rebrov, Evgeny;Panjabi, Rohan;Mong, Guo Ren;Foo, Chuan Yi;Lee, Chia Hau;Bogush, Anna;Hinrichsen, Olaf;Wong, Syie Luing
Reaction kinetics and product distributions in thermal and catalytic pyrolysis of agricultural mulch films over HZSM-5 zeolite
Chemical Engineering Journal
2025
522
167458

Kong, Lingdi;Köhler, Klaus
Stability and Deactivation Behavior of Cuprous Acetylide Containing Catalysts in Reppe Ethynylation
Catalysts
2025
15
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829

Tran Pham, Nhat Long;Qian, Simon;Götsch, Thomas;Grön, Corbinian;Velasco-Vélez, Juan Jesus;Stühmeier, Björn M.;Knop-Gericke, Axel;Gasteiger, Hubert A.;Piana, Michele
Elucidating the Hydrogen Selectivity of Pt/TiO_x/C as a Fuel-Cell Catalyst by Operando Near-Ambient-Pressure XPS
ACS Applied Materials & Interfaces
2025
17
36
50626-50638

Qian, Simon;Freiberg, Anna T. S.;Friedrich, Franziska;Grön, Corbinian;Gasteiger, Hubert A.
Simulating Electrochemical Aging in NCM111 Materials Through Controlled Chemical Delithiation
Journal of The Electrochemical Society
2025
172
8
080535