المؤلفون: Wanyu Deng, Peng Zhang, Yu Qiao, Georg Kastlunger, Nitish Govindarajan, Aoni Xu, Ib Chorkendorff, Brian Seger, Jinlong Gong

المصدر: Nature Communications, Vol 15, Iss 1, Pp 1-8 (2024)

مصطلحات موضوعية: Science

وصف الملف: electronic resource

Relation: https://doaj.org/toc/2041-1723

URL الوصول: https://doaj.org/article/66b3e197ad11402796c8db61cea12f4b

المؤلفون: Ahmed M. Abdellah, Fatma Ismail, Oliver W. Siig, Jie Yang, Carmen M. Andrei, Liza-Anastasia DiCecco, Amirhossein Rakhsha, Kholoud E. Salem, Kathryn Grandfield, Nabil Bassim, Robert Black, Georg Kastlunger, Leyla Soleymani, Drew Higgins

المصدر: Nature Communications, Vol 15, Iss 1, Pp 1-15 (2024)

مصطلحات موضوعية: Science

وصف الملف: electronic resource

Relation: https://doaj.org/toc/2041-1723

URL الوصول: https://doaj.org/article/d1c7a154f14b4fbe8002d7f284550e96

المؤلفون: Chao Zhang, Jun Cheng, Yiming Chen, Maria K Y Chan, Qiong Cai, Rodrigo P Carvalho, Cleber F N Marchiori, Daniel Brandell, C Moyses Araujo, Ming Chen, Xiangyu Ji, Guang Feng, Kateryna Goloviznina, Alessandra Serva, Mathieu Salanne, Toshihiko Mandai, Tomooki Hosaka, Mirna Alhanash, Patrik Johansson, Yun-Ze Qiu, Hai Xiao, Michael Eikerling, Ryosuke Jinnouchi, Marko M Melander, Georg Kastlunger, Assil Bouzid, Alfredo Pasquarello, Seung-Jae Shin, Minho M Kim, Hyungjun Kim, Kathleen Schwarz, Ravishankar Sundararaman

المصدر: JPhys Energy, Vol 5, Iss 4, p 041501 (2023)

مصطلحات موضوعية: electrochemical interfaces, density-functional theory, molecular dynamics simulation, electrochemical energy storage, machine learning, electrocatalysis, Production of electric energy or power. Powerplants. Central stations, TK1001-1841, Renewable energy sources, TJ807-830

وصف الملف: electronic resource

Relation: https://doaj.org/toc/2515-7655

URL الوصول: https://doaj.org/article/8c5d346f35724189abcdaad5187166a6

المؤلفون: Georg Kastlunger, Hendrik H. Heenen, Nitish Govindarajan

المصدر: ACS Catalysis. 13:5062-5072

مصطلحات موضوعية: General Chemistry, Catalysis

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_________::5d1e530bb6219d0489dcf2ced18cd10d
https://doi.org/10.1021/acscatal.3c00228

المؤلفون: Degenhart Hochfilzer, Aoni Xu, Jakob Ejler Sørensen, Julius Lucas Needham, Kevin Krempl, Karl Krøjer Toudahl, Georg Kastlunger, Ib Chorkendorff, Karen Chan, Jakob Kibsgaard

المصدر: ACS Catalysis. 12:5155-5161

مصطلحات موضوعية: General Chemistry, Catalysis

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_________::4d2f783faf4d408e8ff15c5021d44686
https://doi.org/10.1021/acscatal.2c00412

المؤلفون: Sihang Liu, Sudarshan Vijay, Mianle Xu, Ang Cao, Hector Prats, Georg Kastlunger, Hendrik Heenen, Nitish Govindarajan

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_________::70327018fad930d03d05b2618813434a
https://doi.org/10.26434/chemrxiv-2023-b9mtd

المؤلفون: Aoni Xu, Nitish Govindarajan, Georg Kastlunger, Sudarshan Vijay, Karen Chan

المصدر: Accounts of Chemical Research. 55:495-503

مصطلحات موضوعية: General Medicine, General Chemistry

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_________::d827ce95a30becb8e44f87582d2d597a
https://doi.org/10.1021/acs.accounts.1c00679

المؤلفون: Hendrik H. Heenen, Haeun Shin, Georg Kastlunger, Sean Overa, Joseph A. Gauthier, Feng Jiao, Karen Chan

المصدر: Heenen, H H, Shin, H, Kastlunger, G, Overa, S, Gauthier, J A, Jiao, F & Chan, K 2022, ' The mechanism for acetate formation in electrochemical CO (2) reduction on Cu : selectivity with potential, pH, and nanostructuring ', Energy and Environmental Science, vol. 15, no. 9, pp. 3978-3990 . https://doi.org/10.1039/d2ee01485h
Energy & Environmental Science

مصطلحات موضوعية: Nuclear Energy and Engineering, Renewable Energy, Sustainability and the Environment, Environmental Chemistry, Pollution

وصف الملف: application/pdf

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::3166fe071cbb8e241e5b218f766596a2
https://doi.org/10.1039/d2ee01485h

المؤلفون: Ahmed Abdellah, Fatma Ismail, Oliver Siig, Jie Yang, Carmen Andrei, LIza DiCecco, Amirhossein Rakhsha, Kholoud Salem, Kathryn Grandfield, Nabil Bassim, Robert Black, Georg Kastlunger, Leyla Soleymani, Drew Higgins

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_________::70cf97b9df192e91a1b8fe7cfd243d15
https://doi.org/10.26434/chemrxiv-2023-t0b00

المؤلفون: Wanyu Deng, Yu Qiao, Georg Kastlunger, Nitish Govindarajan, Aoni Xu, Peng Zhang, Ib Chorkendorff, Brian Seger, Jinlong Gong

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_________::cfbd430a794e75029bae27246e689401
https://doi.org/10.21203/rs.3.rs-2376669/v1

المؤلفون: Sihang Liu, Zamaan Mukadam, Soren B. Scott, Saurav Ch. Sarma, Maria-Magdalena Titirici, Karen Chan, Nitish Govindarajan, Ifan E. L. Stephens, Georg Kastlunger

المصدر: EES Catalysis.

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::0f96636adc3a6bc5e2cbc0928cb6a3a4
https://doi.org/10.1039/d3ey00040k

المؤلفون: Per Lindgren, Georg Kastlunger, Andrew A. Peterson

المصدر: Atomic-Scale Modelling of Electrochemical Systems

مصطلحات موضوعية: Materials science, Jellium, Periodic boundary conditions, Density functional theory, Molecular physics, Energy (signal processing)

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_________::21a78a1db5df409eea7162f0a8af39cc
https://doi.org/10.1002/9781119605652.ch10

المؤلفون: Jens K. Nørskov, Georg Kastlunger, Karen Chan, Sudarshan Vijay, Anjli M. Patel

المصدر: The Journal of Physical Chemistry Letters. 12:5193-5200

مصطلحات موضوعية: Reaction mechanism, Materials science, Hydronium, Polyatomic ion, Protonation, 02 engineering and technology, 010402 general chemistry, 021001 nanoscience & nanotechnology, 01 natural sciences, Bond order, 0104 chemical sciences, Catalysis, Monatomic ion, chemistry.chemical_compound, chemistry, Chemical physics, General Materials Science, Density functional theory, Physical and Theoretical Chemistry, 0210 nano-technology

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::c8ef5a32af5609b6faa7436d7792650b
https://doi.org/10.1021/acs.jpclett.1c00800

المؤلفون: Hendrik H. Heenen, Haeun Shin, Georg Kastlunger, Sean Overa, Joseph A. Gauthier, Feng Jiao, Karen Chan

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::418c15694277d9306582ae06986d3d65
https://doi.org/10.26434/chemrxiv-2021-p3d4s-v2

المؤلفون: Nitish Govindarajan, Hendrik H. Heenen, Karen Chan, Georg Kastlunger

المصدر: Chemical Science
Govindarajan, N, Kastlunger, G, Heenen, H H & Chan, K 2022, ' Improving the intrinsic activity of electrocatalysts for sustainable energy conversion : where are we and where can we go? ', Chemical Science, vol. 13, pp. 14-26 . https://doi.org/10.1039/D1SC04775B

مصطلحات موضوعية: Intrinsic activity, business.industry, Earth abundant, General Chemistry, Electrocatalyst, Renewable energy, Sustainable energy, Chemistry, System level optimization, Paradigm shift, SDG 13 - Climate Action, Environmental science, SDG 7 - Affordable and Clean Energy, Biochemical engineering, Sustainable production, business

وصف الملف: application/pdf

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::23ce2088dd5ea3e0aebf29d645af6116
https://hdl.handle.net/21.11116/0000-0009-904F-C21.11116/0000-0009-B63B-8

المؤلفون: Per Lindgren, Georg Kastlunger, Andrew A. Peterson

المصدر: Lindgren, P, Kastlunger, G & Peterson, A A 2022, ' Electrochemistry from the atomic scale, in the electronically grand-canonical ensemble ', Journal of Chemical Physics, vol. 157, 180902 . https://doi.org/10.1063/5.0123656

مصطلحات موضوعية: General Physics and Astronomy, Physical and Theoretical Chemistry

وصف الملف: application/pdf

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::ba47137ff7d938fabccdcf916f9fd060
https://orbit.dtu.dk/en/publications/b9e3f0be-904a-4476-8568-29c8824eb306

المؤلفون: Sudarshan Vijay, Georg Kastlunger, Karen Chan, Jens K. Nørskov

المصدر: The Journal of Chemical Physics

مصطلحات موضوعية: General Physics and Astronomy, Physical and Theoretical Chemistry

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::21147ce6e7646d1578e0657d3a31e65a

المؤلفون: Christopher Hahn, Hendrik H. Heenen, Karen Chan, Lei Wang, Georg Kastlunger, Thomas F. Jaramillo, Stefan Ringe, Nitish Govindarajan

مصطلحات موضوعية: Reaction rate, Reaction mechanism, chemistry.chemical_compound, Tafel equation, chemistry, Inorganic chemistry, Protonation, Electrolyte, Electrochemistry, Rate-determining step, Methane

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_________::f4b529cf45ffa286bef32b1a0353a054
https://doi.org/10.33774/chemrxiv-2021-jn28g-v2

المؤلفون: Georg Kastlunger, Lei Wang, Nitish Govindarajan, Hendrik H. Heenen, Stefan Ringe, Thomas Jaramillo, Christopher Hahn, Karen Chan

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::4edfd2083a1ce408bfbffc73746aaa0e
https://doi.org/10.33774/chemrxiv-2021-jn28g

المؤلفون: Andrew A. Peterson, Per Lindgren, Georg Kastlunger

المصدر: ACS Catalysis. 10:121-128

مصطلحات موضوعية: Hydrogen, 010405 organic chemistry, Chemistry, Binding energy, chemistry.chemical_element, General Chemistry, 010402 general chemistry, Photochemistry, 01 natural sciences, Catalysis, 0104 chemical sciences, Interpretation (model theory), High activity, Hydrogen evolution, Platinum

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_________::61c420e38a25f2aad9a00376334a7af4
https://doi.org/10.1021/acscatal.9b02799