Zobrazeno 1 - 10
of 488
pro vyhledávání: '"A. Della Pia"'
Publikováno v:
Physics of Fluids 36, 105187 (2024)
We use parsimonious diffusion maps (PDMs) to discover the latent dynamics of high-fidelity Navier-Stokes simulations with a focus on the 2D fluidic pinball problem. By varying the Reynolds number, different flow regimes emerge, ranging from steady sy
Externí odkaz:
http://arxiv.org/abs/2408.02630
Autor:
Della Pia, Flaviano, Zen, Andrea, Kapil, Venkat, Thiemann, Fabian L., Alfè, Dario, Michaelides, Angelos
Water confined in nanoscale cavities plays a crucial role in everyday phenomena in geology and biology, as well as technological applications at the water-energy nexus. However, even understanding the basic properties of nano-confined water is extrem
Externí odkaz:
http://arxiv.org/abs/2406.18448
Autor:
Kaur, Harveen, Della Pia, Flaviano, Batatia, Ilyes, Advincula, Xavier R., Shi, Benjamin X., Lan, Jinggang, Csányi, Gábor, Michaelides, Angelos, Kapil, Venkat
Calculating sublimation enthalpies of molecular crystal polymorphs is relevant to a wide range of technological applications. However, predicting these quantities at first-principles accuracy -- even with the aid of machine learning potentials -- is
Externí odkaz:
http://arxiv.org/abs/2405.20217
Autor:
Tong, J., Fu, Y., Domaretskiy, D., Della Pia, F., Dagar, P., Powell, L., Bahamon, D., Huang, S., Xin, B., Filho, R. N. Costa, Vega, L. F., Grigorieva, I. V., Peeters, F. M., Michaelides, A., Lozada-Hidalgo, M.
Publikováno v:
Nature 2024
The basal plane of graphene can function as a selective barrier that is permeable to protons but impermeable to all ions and gases, stimulating its use in applications such as membranes, catalysis and isotope separation. Protons can chemically adsorb
Externí odkaz:
http://arxiv.org/abs/2404.06823
Molecular crystals play a central role in a wide range of scientific fields, including pharmaceuticals and organic semiconductor devices. However, they are challenging systems to model accurately with computational approaches because of a delicate in
Externí odkaz:
http://arxiv.org/abs/2402.13059
Autor:
Batatia, Ilyes, Benner, Philipp, Chiang, Yuan, Elena, Alin M., Kovács, Dávid P., Riebesell, Janosh, Advincula, Xavier R., Asta, Mark, Avaylon, Matthew, Baldwin, William J., Berger, Fabian, Bernstein, Noam, Bhowmik, Arghya, Blau, Samuel M., Cărare, Vlad, Darby, James P., De, Sandip, Della Pia, Flaviano, Deringer, Volker L., Elijošius, Rokas, El-Machachi, Zakariya, Falcioni, Fabio, Fako, Edvin, Ferrari, Andrea C., Genreith-Schriever, Annalena, George, Janine, Goodall, Rhys E. A., Grey, Clare P., Grigorev, Petr, Han, Shuang, Handley, Will, Heenen, Hendrik H., Hermansson, Kersti, Holm, Christian, Jaafar, Jad, Hofmann, Stephan, Jakob, Konstantin S., Jung, Hyunwook, Kapil, Venkat, Kaplan, Aaron D., Karimitari, Nima, Kermode, James R., Kroupa, Namu, Kullgren, Jolla, Kuner, Matthew C., Kuryla, Domantas, Liepuoniute, Guoda, Margraf, Johannes T., Magdău, Ioan-Bogdan, Michaelides, Angelos, Moore, J. Harry, Naik, Aakash A., Niblett, Samuel P., Norwood, Sam Walton, O'Neill, Niamh, Ortner, Christoph, Persson, Kristin A., Reuter, Karsten, Rosen, Andrew S., Schaaf, Lars L., Schran, Christoph, Shi, Benjamin X., Sivonxay, Eric, Stenczel, Tamás K., Svahn, Viktor, Sutton, Christopher, Swinburne, Thomas D., Tilly, Jules, van der Oord, Cas, Varga-Umbrich, Eszter, Vegge, Tejs, Vondrák, Martin, Wang, Yangshuai, Witt, William C., Zills, Fabian, Csányi, Gábor
Machine-learned force fields have transformed the atomistic modelling of materials by enabling simulations of ab initio quality on unprecedented time and length scales. However, they are currently limited by: (i) the significant computational and hum
Externí odkaz:
http://arxiv.org/abs/2401.00096
Ice is one of the most important and interesting molecular crystals exhibiting a rich and evolving phase diagram. Recent discoveries mean that there are now twenty distinct polymorphs; a structural diversity that arises from a delicate interplay of h
Externí odkaz:
http://arxiv.org/abs/2207.01353
Autor:
Adnan Danish, Alexandra Della Pia, Lindsay Fogel, Hassan Alkhatatneh, Charles Zhao, Tony Varughese, Karine A. Al Feghali, Lauren Pascual, Brittany Sinclaire, Michael Marafelias, Joshua Zenreich, Yen-Hong Kuo, Tatyana A. Feldman, Yi Zhang, Andre H. Goy, Andrew Ip, Scott D. Rowley
Publikováno v:
Frontiers in Oncology, Vol 14 (2024)
Background and purposeThe aim of this study was to determine the prevalence of patients with relapsed or refractory (R/R) non-Hodgkin lymphoma (NHL) meeting high-risk criteria for early relapse after CD19 CAR T-cell therapy (CART) who have disease en
Externí odkaz:
https://doaj.org/article/8182706d74724ca58c0b8faeef2b98b0
Autor:
Michael Raver, Bianca DeAgresta, Alexandra Della Pia, Cara Wong, Grace Basralian, Jennifer Nguyen, Nitin Yerram
Publikováno v:
Urology Case Reports, Vol 55, Iss , Pp 102778- (2024)
Caval thrombus with intracardiac involvement is a rare condition that is associated with renal cell carcinoma. Few reports in literature describe this presentation with metastatic melanoma. Metastatic melanoma is known to involve the adrenal gland, a
Externí odkaz:
https://doaj.org/article/137a7da54d4a489298083f70db9f4ee8
Publikováno v:
In Clinical Lymphoma, Myeloma and Leukemia August 2024 24(8):491-505