المؤلفون: Grima Torres, Rogeli, Vizcaíno, Pablo, Mantovani, Filippo, Gutiérrez Moreno, José Julio

المصدر: Open Research Europe, (2024-11-14)

مصطلحات موضوعية: High-performance computing, co-design, ab initio, RISC-V, materials science, eigensolver library, European processor initiative

Relation: https://doi.org/10.1063/5.0012901; https://doi.org/10.1088/1361-651X/acdf06; https://doi.org/10.1088/0953-8984/26/21/213201; https://doi.org/10.1016/j.parco.2019.04.003; https://doi.org/10.1016/j.cpc.2020.107808; https://doi.org/10.1016/0927-0256(96)00008-0; https://doi.org/10.1063/5.0005077; https://doi.org/10.1088/1361-648X/aa8f79; https://doi.org/10.1016/j.cpc.2016.04.003; https://doi.org/10.1088/0953-8984/26/36/363202; https://doi.org/10.1016/j.cpc.2009.06.022; https://doi.org/10.1063/5.0182685; https://doi.org/10.1063/5.0007045; https://doi.org/10.1016/j.cpc.2020.107459; https://doi.org/10.3390/computation10030043; https://doi.org/10.1088/2399-1984/ad32d2; https://doi.org/10.1145/3575861; https://doi.org/10.1002/cpe.7424; https://doi.org/10.1145/3437801.3441592; https://doi.org/10.1109/IPDPS57955.2024.00047; https://doi.org/10.1007/978-3-031-40843-4_39; https://doi.org/10.12688/openreseurope.16920.2; https://doi.org/10.1145/3624062.3624231; https://doi.org/10.12688/openreseurope.18321.2; https://doi.org/10.12688/openreseurope.18321.3; oai:zenodo.org:14167098

الاتاحة: https://doi.org/10.12688/openreseurope.18321.3

المؤلفون: Mas Magre, Isidre, Grima Torres, Rogeli, Cela Espín, José María, Gutierrez Moreno, José Julio

المصدر: Open Research Europe, (2024-02-19)

مصطلحات موضوعية: High-performance computing, exascale, ab initio calculations, materials science, eigensolver library, Green's function methods, co-design, mini-apps

Relation: https://doi.org/10.1038/s41578-023-00540-6; https://doi.org/10.1088/1361-651X/acdf06; https://doi.org/10.1016/j.parco.2019.04.003; https://doi.org/10.1016/j.softx.2017.11.002; https://doi.org/10.21105/joss.05570; https://doi.org/10.3390/computation10030043; https://doi.org/10.1016/j.cpc.2020.107459; https://doi.org/10.4310/CMS.2009.v7.n3.a12; https://doi.org/10.1088/0953-8984/25/29/295501; https://doi.org/10.1002/advs.201900808; https://doi.org/10.1016/j.commatsci.2020.110086; https://doi.org/10.1088/1361-648X/aa680e; https://doi.org/10.1016/j.commatsci.2021.110731; https://doi.org/10.1002/cpe.3505; https://doi.org/10.1007/978-3-030-63393-6_23; https://doi.org/10.1063/5.0018516; https://doi.org/10.1109/CLUSTER.2017.126; https://doi.org/10.2172/993908; https://doi.org/10.1016/j.jpdc.2014.09.006; https://doi.org/10.1109/CLUSTER.2017.123; https://doi.org/10.3030/676580; https://doi.org/10.1088/0953-8984/26/21/213201; https://doi.org/10.1103/PhysRevB.94.035118; https://doi.org/10.1088/0953-8984/26/36/363202; https://doi.org/10.1016/S0927-0256(02)00325-7; https://doi.org/10.1016/j.cpc.2016.04.003; https://doi.org/10.1016/j.cpc.2019.107042; https://doi.org/10.1016/j.cpc.2009.06.022; https://doi.org/10.1103/PhysRevMaterials.5.013807; https://doi.org/10.1103/PhysRev.139.A796; https://doi.org/10.3389/fchem.2019.00377; https://doi.org/10.1088/0034-4885/61/3/002; https://doi.org/10.1088/1367-2630/17/9/093020; https://doi.org/10.5281/zenodo.10142415; https://doi.org/10.12688/openreseurope.16920.1; oai:zenodo.org:12662682

الاتاحة: https://doi.org/10.12688/openreseurope.16920.1

المؤلفون: Daly, Robert, Narayan, Tarun, Diaz, Fernando, Shao, Han, Gutierrez Moreno, Jose Julio, Nolan, Michael, O’Riordan, Alan, Lovera, Pierre

المساهمون: European Union, Irish EPA Uiscesense Project, Marie Sklodowska-Curie, Science Foundation Ireland, Department of Agriculture, Food and the Marine

المصدر: Nanotechnology ; volume 35, issue 28, page 285704 ; ISSN 0957-4484 1361-6528

الاتاحة: http://dx.doi.org/10.1088/1361-6528/ad373c
https://iopscience.iop.org/article/10.1088/1361-6528/ad373c
https://iopscience.iop.org/article/10.1088/1361-6528/ad373c/pdf

المؤلفون: Mullins, Rita, Gutiérrez Moreno, José Julio, Nolan, Michael

المساهمون: Barcelona Supercomputing Center

مصطلحات موضوعية: Àrees temàtiques de la UPC::Informàtica::Aplicacions de la informàtica::Aplicacions informàtiques a la física i l‘enginyeria, Thin films, Semiconductor devices, Atomic layer deposition, HfO2, Thermal atomic layer etching (ALE), Nanoescala (Electrònica)

وصف الملف: 11 p.; application/pdf

Relation: https://aip-prod-cdn.literatumonline.com/journals/content/jva/2022/jva.2022.40.issue-2/6.0001614/20220228/suppl/supplemental_material_ahfo2_ale_modelling.pdf?b92b4ad1b4f274c70877518511abb28bed2c6f7421a565d9f7a5b3e3f5a40bc644191f5cacfb3cc9bc55304dc1c37156f8ea51e147a9f9df7ba4490c43ba408af9a38907dbd79182611f2f4f1602f33a306c6ff205e5c2c75662c0afbda550b42623be4b1d3774d9ef69f863ffb0b397eb65eb858aa89df60194efef8d8639d42a400e803659110d15d886fd5471aa8d16d62f72c372a0de8035b68ba8a17d4ade00b52999; Mullins, R.; Gutiérrez Moreno, J.J.; Nolan, M. Origin of enhanced thermal atomic layer etching of amorphous HfO2. "Journal of Vacuum Science and Technology A (JVST A)", Febrer 2022, vol. 40, núm. 2, 022604.; http://hdl.handle.net/2117/364638

الاتاحة: http://hdl.handle.net/2117/364638
https://doi.org/10.1116/6.0001614

المؤلفون: Kalha, Curran, Ratcliff, Laura, Gutierrez Moreno, Jose Julio, Mohr, Stephan, Mantsinen, Mervi

المساهمون: Barcelona Supercomputing Center

مصطلحات موضوعية: Àrees temàtiques de la UPC::Informàtica::Aplicacions de la informàtica::Aplicacions informàtiques a la física i l‘enginyeria, Condensed matter, X-ray photoelectron spectroscopy, Tungsten metal, X-ray photoelectron spectroscopy (XPS), Photoelectron spectrum, Satellite, Metalls

وصف الملف: application/pdf

Relation: https://journals.aps.org/prb/abstract/10.1103/PhysRevB.105.045129; Kalha, C. [et al.]. Lifetime effects and satellites in the photoelectron spectrum of tungsten metal. "Physical Review B", 2022, vol. 105, 045129.; http://hdl.handle.net/2117/364636

الاتاحة: http://hdl.handle.net/2117/364636
https://doi.org/10.1103/PhysRevB.105.045129

المؤلفون: Doustkhah, Esmail, Yusufoğlu, Muhammed, El-Hosainy, Hamza, Zarenezhad, Hamaneh, Ide, Yusuke, Gutiérrez Moreno, José Julio, Assadi, M. Hussein N.

المساهمون: European Research Council, Agencia Estatal de Investigaci?n, T?rkiye Bilimsel ve Teknolojik Arastirma Kurumu, Japan Science and Technology Corporation

المصدر: ACS Applied Materials & Interfaces ; volume 16, issue 47, page 64736-64744 ; ISSN 1944-8244 1944-8252

الاتاحة: https://doi.org/10.1021/acsami.4c13770
https://pubs.acs.org/doi/pdf/10.1021/acsami.4c13770

المؤلفون: Gutierrez Moreno, José Julio

المساهمون: Barcelona Supercomputing Center

مصطلحات موضوعية: Àrees temàtiques de la UPC::Informàtica::Aplicacions de la informàtica::Aplicacions informàtiques a la física i l‘enginyeria, Exascale computing, Nanomaterials, Material sciences, Molecular sciences, High-performance computing platforms, Supercomputadors, Simulació per ordinador

وصف الملف: application/pdf

Relation: https://iopscience.iop.org/article/10.1088/2399-1984/ad32d2; Gutierrez Moreno, J.J. Ab initio guided atomistic modelling of nanomaterials on exascale high-performance computing platforms. "Nano Futures", 2024; http://hdl.handle.net/2117/404406

الاتاحة: http://hdl.handle.net/2117/404406
https://doi.org/10.1088/2399-1984/ad32d2

المؤلفون: Kalha, Curran, Fernando, Nathalie Kanchena, Berens, Judith, Gutierrez Moreno, Jose Julio, Mohr, Stephan

المساهمون: Barcelona Supercomputing Center

مصطلحات موضوعية: Àrees temàtiques de la UPC::Física, Alloys, X-ray photoelectron spectroscopy, Titanium alloys, Annealing, Depth profiling techniques, Metallization process, Microfabrication, Density functional theory, Diffusion barriers, Semiconductor devices, Semiconductors

وصف الملف: 15 p.; application/pdf

Relation: https://nomad-lab.eu/prod/rae/gui/dataset/id/n7Q2rvmFTUKaOw9B_KwD3Q; Kalha, C. [et al.]. Thermal and oxidation stability of TixW1−x diffusion barriers investigated by soft and hard x-ray photoelectron spectroscopy. "Journal of Applied Physics", 2021, vol. 129, núm. 19, 195302.; http://hdl.handle.net/2117/345840

الاتاحة: http://hdl.handle.net/2117/345840
https://doi.org/10.1063/5.0048304

المؤلفون: Gutiérrez Moreno, José Julio, Panagiotopoulos, Nikolaos T, Evangelakis, Georgios A, Lekka, Christina E

مصطلحات موضوعية: Ti alloys, X-ray diffraction, biocompatible materials, density functional theory, magnetron sputtering, thin film, β-phase

وصف الملف: application/zip; text/xml; application/pdf

Relation: https://www.repository.cam.ac.uk/handle/1810/303476

الاتاحة: https://www.repository.cam.ac.uk/handle/1810/303476
https://doi.org/10.17863/CAM.50564

المؤلفون: Ivanov, Ivan, Gutiérrez Moreno, José Julio, Emurlaev, Kemal, Lazurenko, Daria, Bataev, Ivan

المصدر: Materials today / Communications 35, 106298 (2023). doi:10.1016/j.mtcomm.2023.106298

مصطلحات موضوعية: info:eu-repo/classification/ddc/620

جغرافية الموضوع: DE

Relation: info:eu-repo/semantics/altIdentifier/issn/2352-4928; https://bib-pubdb1.desy.de/record/599964; https://bib-pubdb1.desy.de/search?p=id:%22PUBDB-2023-07653%22

الاتاحة: https://bib-pubdb1.desy.de/record/599964
https://bib-pubdb1.desy.de/search?p=id:%22PUBDB-2023-07653%22

المؤلفون: Li, Yongtao, Gutiérrez Moreno, José Julio, Song, Zhaoqi, Liu, Dongqing, Wang, Maoyu, Ramiere, Aymeric, Feng, Zhenxing, Niu, Qingshan Jason, Sasaki, Takayoshi, Cai, Xingke

المساهمون: Ministry of Education, Culture, Sports, Science and Technology, China Postdoctoral Science Foundation, Core Research for Evolutional Science and Technology, Science, Technology and Innovation Commission of Shenzhen Municipality, Japan Society for the Promotion of Science, National Natural Science Foundation of China, Shenzhen University

المصدر: ACS Applied Materials & Interfaces ; volume 14, issue 16, page 18513-18524 ; ISSN 1944-8244 1944-8252

الاتاحة: http://dx.doi.org/10.1021/acsami.2c01474
https://pubs.acs.org/doi/pdf/10.1021/acsami.2c01474

المؤلفون: Barcelona Supercomputing Center, Mullins, Rita, Gutiérrez Moreno, José Julio, Nolan, Michael

مصطلحات الفهرس: Àrees temàtiques de la UPC::Informàtica::Aplicacions de la informàtica::Aplicacions informàtiques a la física i l‘enginyeria, Thin films, Semiconductor devices, Atomic layer deposition, HfO2, Thermal atomic layer etching (ALE), Nanoescala (Electrònica), Article

URL: http://hdl.handle.net/2117/364638
https://aip-prod-cdn.literatumonline.com/journals/content/jva/2022/jva.2022.40.issue-2/6.0001614/20220228/suppl/supplemental_material_ahfo2_ale_modelling.pdf?b92b4ad1b4f274c70877518511abb28bed2c6f7421a565d9f7a5b3e3f5a40bc644191f5cacfb3cc9bc55304dc1c37156f8ea51e147a9f9df7ba4490c43ba408af9a38907dbd79182611f2f4f1602f33a306c6ff205e5c2c75662c0afbda550b42623be4b1d3774d9ef69f863ffb0b397eb65eb858aa89df60194efef8d8639d42a400e803659110d15d886fd5471aa8d16d62f72c372a0de8035b68ba8a17d4ade00b52999
https://avs.scitation.org/doi/10.1116/6.0001614
https://aip-prod-cdn.literatumonline.com/journals/content/jva/2022/jva.2022.40.issue-2/6.0001614/20220228/suppl/supplemental_material_ahfo2_ale_modelling.pdf?b92b4ad1b4f274c70877518511abb28bed2c6f7421a565d9f7a5b3e3f5a40bc644191f5cacfb3cc9bc55304dc1c37156f8ea51e147a9f9df7ba4490c43ba408af9a38907dbd79182611f2f4f1602f33a306c6ff205e5c2c75662c0afbda550b42623be4b1d3774d9ef69f863ffb0b397eb65eb858aa89df60194efef8d8639d42a400e803659110d15d886fd5471aa8d16d62f72c372a0de8035b68ba8a17d4ade00b52999
https://avs.scitation.org/doi/10.1116/6.0001614

المؤلفون: Gutiérrez Moreno, José Julio, Bönisch, M., Panagiotopoulos, N. T., Calin, M., Papageorgiou, D. G., Gebert, A., Eckert, J., Evangelakis, G. A., Lekka, Ch. E.

مصطلحات موضوعية: Biomaterials, Titanium alloys, Phase stability

وصف الملف: application/pdf

Relation: info:eu-repo/grantAgreement/EC/FP7::SP3::PEOPLE/264635/EU/Academic-Industrial Initial Training Network on Innovative Biocompatible Titanium-base Structures for Orthopaedics/BIOTINET; Gutiérrez Moreno, J. J., Bönisch, M., Panagiotopoulos, N. T., Calin, M., Papageorgiou, D. G., Gebert, A., Eckert, J., Evangelakis, G. A. and Lekka, C. E. (2017) 'Ab-initio and experimental study of phase stability of Ti-Nb alloys', Journal of Alloys and Compounds, 696, pp. 481-489. 10.1016/j.jallcom.2016.11.231; 489; Journal of Alloys and Compounds; 481; http://hdl.handle.net/10468/3552; 696

الاتاحة: http://hdl.handle.net/10468/3552
https://doi.org/10.1016/j.jallcom.2016.11.231

المؤلفون: Balerba, Athanasia K., Kotanidis, Alexis, Paraskeuas, Angelos, Gialampouki, Martha, Gutiérrez Moreno, José Julio, Papageorgiou, Dimitrios G., Evangelakis, Georgios A., Lekka, Christina E.

المصدر: Computational Modelling of Nanomaterials ; Frontiers of Nanoscience ; page 141-159 ; ISSN 1876-2778 ; ISBN 9780128214954

الاتاحة: http://dx.doi.org/10.1016/b978-0-12-821495-4.00009-9
https://api.elsevier.com/content/article/PII:B9780128214954000099?httpAccept=text/xml
https://api.elsevier.com/content/article/PII:B9780128214954000099?httpAccept=text/plain

المؤلفون: Assadi, M. Hussein N., Gutiérrez Moreno, José Julio, Hanaor, Dorian A. H., Katayama-Yoshida, Hiroshi

المساهمون: European Regional Development Fund

المصدر: Physical Chemistry Chemical Physics ; volume 23, issue 36, page 20129-20137 ; ISSN 1463-9076 1463-9084

الاتاحة: http://dx.doi.org/10.1039/d1cp02164h
http://pubs.rsc.org/en/content/articlepdf/2021/CP/D1CP02164H

المؤلفون: Mullins, Rita, Gutiérrez Moreno, Jose Julio, Nolan, Michael

المساهمون: Science Foundation Ireland

الاتاحة: http://dx.doi.org/10.26434/chemrxiv-2021-7lq8s
https://chemrxiv.org/engage/api-gateway/chemrxiv/assets/orp/resource/item/6183ac019b583aca9deb1f67/original/origin-of-enhanced-thermal-atomic-layer-etching-of-amorphous-hf-o2.pdf

المؤلفون: Gutiérrez Moreno, José Julio, Pan, Ke, Wang, Yu, Li, Wenjin

المساهمون: China Postdoctoral Science Foundation, National Natural Science Foundation of China, Shenzhen University, Startup Foundation for Peacock Talents

المصدر: Langmuir ; volume 36, issue 20, page 5680-5689 ; ISSN 0743-7463 1520-5827

الاتاحة: http://dx.doi.org/10.1021/acs.langmuir.9b03755
https://pubs.acs.org/doi/pdf/10.1021/acs.langmuir.9b03755

المؤلفون: Mullins, Rita, Gutiérrez Moreno, José Julio, Nolan, Michael

المصدر: Journal of Vacuum Science & Technology: Part A-Vacuums, Surfaces & Films; Mar2022, Vol. 40 Issue 2, p1-10, 10p

مصطلحات موضوعية: ETCHING, CHEMICAL precursors, NANOELECTROMECHANICAL systems, CHEMICAL reactions, DENSITY functional theory, SEMICONDUCTOR devices

المؤلفون: UCL - SST/IMCN - Institute of Condensed Matter and Nanosciences, Balerba, Athanasia K., Kotanidis, Alexis, Paraskeuas, Angelos, Gialampouki, Martha, Gutiérrez Moreno, José Julio, Papageorgiou, Dimitrios G., Evangelakis, Georgios A., Lekka, Christina E.

مصطلحات الفهرس: Density functional theory, Graphene, Metallic surfaces, Molecular dynamics simulations, info:eu-repo/semantics/bookPart

URL: http://hdl.handle.net/2078.1/252019

المؤلفون: Creedon, Niamh, Lovera, Pierre, Gutierrez Moreno, Jose Julio, Nolan, Michael, O'Riordan, Alan

الاتاحة: http://dx.doi.org/10.26434/chemrxiv.7151924.v2
https://chemrxiv.org/engage/api-gateway/chemrxiv/assets/orp/resource/item/60c7496b337d6c723ce276e2/original/highly-sensitive-sers-detection-of-neonicotinoid-pesticides-complete-raman-spectral-assignment-of-clothianidin-and-imidacloprid.pdf