المؤلفون: Eckert, Hagen, Divilov, Simon, Mehl, Michael J., Hicks, David, Zettel, Adam C., Esters, Marco, Campilongo, Xiomara, Curtarolo, Stefano

المصدر: Computational Materials Science, 2024, Volume 240, 112988

مصطلحات موضوعية: Condensed Matter - Materials Science

URL الوصول: http://arxiv.org/abs/2401.06875

المؤلفون: Esters, Marco, Smolyanyuk, Andriy, Oses, Corey, Hicks, David, Divilov, Simon, Eckert, Hagen, Campilongo, Xiomara, Toher, Cormac, Curtarolo, Stefano

مصطلحات موضوعية: Condensed Matter - Materials Science

URL الوصول: http://arxiv.org/abs/2212.00919

المؤلفون: Esters, Marco, Oses, Corey, Divilov, Simon, Eckert, Hagen, Friedrich, Rico, Hicks, David, Mehl, Michael J., Rose, Frisco, Smolyanyuk, Andriy, Calzolari, Arrigo, Campilongo, Xiomara, Toher, Cormac, Curtarolo, Stefano

مصطلحات موضوعية: Condensed Matter - Materials Science, Computer Science - Databases

URL الوصول: http://arxiv.org/abs/2207.09842

المؤلفون: Toher, Cormac, Oses, Corey, Esters, Marco, Hicks, David, Kotsonis, George N., Rost, Christina M., Brenner, Donald W., Maria, Jon-Paul, Curtarolo, Stefano

مصطلحات موضوعية: Condensed Matter - Materials Science

URL الوصول: http://arxiv.org/abs/2111.11519

المؤلفون: Andersen, Casper W., Armiento, Rickard, Blokhin, Evgeny, Conduit, Gareth J., Dwaraknath, Shyam, Evans, Matthew L., Fekete, Ádám, Gopakumar, Abhijith, Gražulis, Saulius, Merkys, Andrius, Mohamed, Fawzi, Oses, Corey, Pizzi, Giovanni, Rignanese, Gian-Marco, Scheidgen, Markus, Talirz, Leopold, Toher, Cormac, Winston, Donald, Aversa, Rossella, Choudhary, Kamal, Colinet, Pauline, Curtarolo, Stefano, Di Stefano, Davide, Draxl, Claudia, Er, Suleyman, Esters, Marco, Fornari, Marco, Giantomassi, Matteo, Govoni, Marco, Hautier, Geoffroy, Hegde, Vinay, Horton, Matthew K., Huck, Patrick, Huhs, Georg, Hummelshøj, Jens, Kariryaa, Ankit, Kozinsky, Boris, Kumbhar, Snehal, Liu, Mohan, Marzari, Nicola, Morris, Andrew J., Mostofi, Arash, Persson, Kristin A., Petretto, Guido, Purcell, Thomas, Ricci, Francesco, Rose, Frisco, Scheffler, Matthias, Speckhard, Daniel, Uhrin, Martin, Vaitkus, Antanas, Villars, Pierre, Waroquiers, David, Wolverton, Chris, Wu, Michael, Yang, Xiaoyu

المصدر: Sci Data 8, 217 (2021)

مصطلحات موضوعية: Condensed Matter - Materials Science

URL الوصول: http://arxiv.org/abs/2103.02068

المؤلفون: Hicks, David, Mehl, Michael J., Esters, Marco, Oses, Corey, Levy, Ohad, Hart, Gus L. W., Toher, Cormac, Curtarolo, Stefano

المصدر: Computational Materials Science (2021)

مصطلحات موضوعية: Condensed Matter - Materials Science

URL الوصول: http://arxiv.org/abs/2012.05961

المؤلفون: Mehl, Michael J., Ronquillo, Mateo, Hicks, David, Esters, Marco, Oses, Corey, Friedrich, Rico, Smolyanyuk, Andriy, Gossett, Eric, Finkenstadt, Daniel, Curtarolo, Stefano

المصدر: Phys. Rev. Materials 5, 083608 (2021)

مصطلحات موضوعية: Condensed Matter - Materials Science

URL الوصول: http://arxiv.org/abs/2010.07168

المؤلفون: Esters, Marco

Thesis Advisors: Johnson, David

مصطلحات موضوعية: Density Functional Theory, Ferecrystals, Heterostructures, Kinetic Solid State Synthesis, Magnetic Properties

الاتاحة: http://hdl.handle.net/1794/23175

المؤلفون: Andersen, Casper W, Armiento, Rickard, Blokhin, Evgeny, Conduit, Gareth J, Dwaraknath, Shyam, Evans, Matthew L, Fekete, Ádám, Gopakumar, Abhijith, Gražulis, Saulius, Merkys, Andrius, Mohamed, Fawzi, Oses, Corey, Pizzi, Giovanni, Rignanese, Gian-Marco, Scheidgen, Markus, Talirz, Leopold, Toher, Cormac, Winston, Donald, Aversa, Rossella, Choudhary, Kamal, Colinet, Pauline, Curtarolo, Stefano, Di Stefano, Davide, Draxl, Claudia, Er, Suleyman, Esters, Marco, Fornari, Marco, Giantomassi, Matteo, Govoni, Marco, Hautier, Geoffroy, Hegde, Vinay, Horton, Matthew K, Huck, Patrick, Huhs, Georg, Hummelshøj, Jens, Kariryaa, Ankit, Kozinsky, Boris, Kumbhar, Snehal, Liu, Mohan, Marzari, Nicola, Morris, Andrew J, Mostofi, Arash A, Persson, Kristin A, Petretto, Guido, Purcell, Thomas, Ricci, Francesco, Rose, Frisco, Scheffler, Matthias, Speckhard, Daniel, Uhrin, Martin, Vaitkus, Antanas, Villars, Pierre, Waroquiers, David, Wolverton, Chris, Wu, Michael, Yang, Xiaoyu

المصدر: Scientific data. 8(1)

وصف الملف: application/pdf

URL الوصول: https://escholarship.org/uc/item/8d88v3s9

المؤلفون: Divilov, Simon, Eckert, Hagen, Hicks, David, Oses, Corey, Toher, Cormac, Friedrich, Rico, Esters, Marco, Mehl, Michael J., Zettel, Adam C., Lederer, Yoav, Zurek, Eva, Maria, Jon-Paul, Brenner, Donald W., Campilongo, Xiomara, Filipović, Suzana, Fahrenholtz, William G., Ryan, Caillin J., DeSalle, Christopher M., Crealese, Ryan J., Wolfe, Douglas E., Calzolari, Arrigo, Curtarolo, Stefano

المصدر: Nature

مصطلحات موضوعية: high-entropy carbides, disordered enthalpy–entropy descriptor, ceramics, AFLOW

Relation: US Office of Naval Research, Multidisciplinary University Research Initiative program, project no. N00014-21-1-2515; US Office of Naval Research, Multidisciplinary University Research Initiative program, project no. N00014-23-1-2615; National Science Foundation (NSF grant no. NRT-HDR DGE-2022040; DoD High-Performance Computing Modernization Programme (Frontier); https://dais.sanu.ac.rs/123456789/16242; http://dais.sanu.ac.rs/bitstream/id/64529/s41586-023-06786-y.pdf; https://hdl.handle.net/21.15107/rcub_dais_16242

الاتاحة: https://dais.sanu.ac.rs/123456789/16242
https://doi.org/10.1038/s41586-023-06786-y
http://dais.sanu.ac.rs/bitstream/id/64529/s41586-023-06786-y.pdf
https://hdl.handle.net/21.15107/rcub_dais_16242

المؤلفون: Oses, Corey, Esters, Marco, Hicks, David, Divilov, Simon, Eckert, Hagen, Friedrich, Rico, Mehl, Michael J., Smolyanyuk, Andriy, Campilongo, Xiomara, van de Walle, Axel, Schroers, Jan, Kusne, A. Gilad, Takeuchi, Ichiro, Zurek, Eva, Nardelli, Marco Buongiorno, Fornari, Marco, Lederer, Yoav, Levy, Ohad, Toher, Cormac, Curtarolo, Stefano

المصدر: Computational Materials Science ; volume 217, page 111889 ; ISSN 0927-0256

الاتاحة: http://dx.doi.org/10.1016/j.commatsci.2022.111889
https://api.elsevier.com/content/article/PII:S0927025622006000?httpAccept=text/xml
https://api.elsevier.com/content/article/PII:S0927025622006000?httpAccept=text/plain

المؤلفون: Wolfe, Douglas E., DeSalle, Christopher M., Ryan, Caillin J., Slapikas, Robert E., Sweny, Ryan T., Crealese, Ryan J., Kolonin, Petr A., Stepanoff, Sergei P., Haque, Aman, Divilov, Simon, Eckert, Hagen, Oses, Corey, Esters, Marco, Brenner, Donald W., Fahrenholtz, William G., Maria, Jon-Paul, Toher, Cormac, Zurek, Eva, Curtarolo, Stefano

المساهمون: U.S. Department of Defense, Office of Naval Research, Office of Naval Research MURI

المصدر: Materialia ; volume 27, page 101682 ; ISSN 2589-1529

الاتاحة: http://dx.doi.org/10.1016/j.mtla.2023.101682
https://api.elsevier.com/content/article/PII:S2589152923000108?httpAccept=text/xml
https://api.elsevier.com/content/article/PII:S2589152923000108?httpAccept=text/plain

المؤلفون: George, Janine, Petretto, Guido, Naik, Aakash, Esters, Marco, Jackson, Adam J., Nelson, Ryky, Dronskowski, Richard, Rignanese, Gian-Marco, Hautier, Geoffroy

المساهمون: UCL - SST/IMCN/MODL - Modelling

المصدر: ChemPlusChem, Vol. -, no.-, p. e202200123 (2022)

مصطلحات موضوعية: General Chemistry

Relation: boreal:263172; http://hdl.handle.net/2078.1/263172; urn:ISSN:2192-6506; urn:EISSN:2192-6506

الاتاحة: http://hdl.handle.net/2078.1/263172
https://doi.org/10.1002/cplu.202200123

المؤلفون: Kulik, Heather J., Hammerschmidt, Thomas, Schmidt, J., Botti, Silvana, Marques, Miguel A. L., Boley, M., Scheffler, M., Todorović, Milica, Rinke, Patrick, Oses, Corey, Smolyanyuk, Andriy, Curtarolo, Stefano, Tkatchenko, A., Bartók, Albert P., Manzhos, Sergei, Ihara, M., Carrington, Tucker, Behler, Jörg, Isayev, Olexandr, Veit, Max, Grisafi, Andrea, Nigam, Jigyasa, Ceriotti, Michele, Schütt, Kristof T., Westermayr, Julia, Gastegger, Michael, Maurer, Reinhard J., Kalita, B., Burke, Kieron, Nagai, R., Akashi, R., Sugino, O., Hermann, J., Noé, Frank, Pilati, Sebastiano, Draxl, Claudia, Kuban, M., Rigamonti, S., Scheidgen, M., Esters, Marco, Hicks, David, Toher, Cormac, Balachandran, Prasanna Venkataraman, Tamblyn, Isaac, Whitelam, S., Bellinger, C., Ghiringhelli, Luca M.

مصطلحات موضوعية: 004 Datenverarbeitung, Informatik, machine learning, electronic structure, computational materials science, density-functional theory

وصف الملف: application/pdf

Relation: https://depositonce.tu-berlin.de/handle/11303/17377; http://dx.doi.org/10.14279/depositonce-16158

الاتاحة: https://depositonce.tu-berlin.de/handle/11303/17377
https://doi.org/10.14279/depositonce-16158

المؤلفون: Calzolari, Arrigo, Oses, Corey, Toher, Cormac, Esters, Marco, Campilongo, Xiomara, Stepanoff, Sergei P., Wolfe, Douglas E., Curtarolo, Stefano

المصدر: Nature Communications ; volume 13, issue 1 ; ISSN 2041-1723

الاتاحة: http://dx.doi.org/10.1038/s41467-022-33497-1
https://www.nature.com/articles/s41467-022-33497-1.pdf
https://www.nature.com/articles/s41467-022-33497-1

المؤلفون: Hossain, Mohammad Delower, Borman, Trent, Oses, Corey, Esters, Marco, Toher, Cormac, Feng, Lun, Kumar, Abinash, Fahrenholtz, William G., Curtarolo, Stefano, Brenner, Donald, LeBeau, James M., Maria, Jon‐Paul

المساهمون: National Science Foundation

المصدر: Advanced Materials ; volume 33, issue 42 ; ISSN 0935-9648 1521-4095

الاتاحة: https://doi.org/10.1002/adma.202102904
https://onlinelibrary.wiley.com/doi/pdf/10.1002/adma.202102904
https://onlinelibrary.wiley.com/doi/full-xml/10.1002/adma.202102904
https://onlinelibrary.wiley.com/doi/am-pdf/10.1002/adma.202102904

المؤلفون: Esters, Marco, Oses, Corey, Hicks, David, Mehl, Michael J., Jahnátek, Michal, Hossain, Mohammad Delower, Maria, Jon-Paul, Brenner, Donald W., Toher, Cormac, Curtarolo, Stefano

المساهمون: United States Department of Defense | United States Navy | Office of Naval Research, United States Department of Defense | United States Navy | ONR | Office of Naval Research Global

المصدر: Nature Communications ; volume 12, issue 1 ; ISSN 2041-1723

الاتاحة: http://dx.doi.org/10.1038/s41467-021-25979-5
https://www.nature.com/articles/s41467-021-25979-5.pdf
https://www.nature.com/articles/s41467-021-25979-5

المؤلفون: George, Janine, Petretto, Guido, Naik, Aakash, Esters, Marco, Jackson, Adam J., Nelson, Ryky, Dronskowski, Richard, Rignanese, Gian-Marco, Hautier, Geoffroy

Relation: https://github.com/JaGeo/LobsterPy/tree/v0.3.5; https://zenodo.org/communities/bam; https://doi.org/10.5281/zenodo.6320073; https://doi.org/10.5281/zenodo.10529156; oai:zenodo.org:10529156

الاتاحة: https://doi.org/10.5281/zenodo.10529156

المؤلفون: George, Janine, Petretto, Guido, Naik, Aakash, Esters, Marco, Jackson, Adam J., Nelson, Ryky, Dronskowski, Richard, Rignanese, Gian-Marco, Hautier, Geoffroy

Relation: https://github.com/JaGeo/LobsterPy/tree/v0.3.7; https://zenodo.org/communities/bam; https://doi.org/10.5281/zenodo.6320073; https://doi.org/10.5281/zenodo.10631237; oai:zenodo.org:10631237

الاتاحة: https://doi.org/10.5281/zenodo.10631237

المؤلفون: Zalden, Peter, Koch, Christine, Paulsen, Melf, Esters, Marco, Johnson, David C., Wuttig, Matthias, Lindenberg, Aaron M., Bensch, Wolfgang

المصدر: Advanced functional materials 31(1), 2004803 (2020). doi:10.1002/adfm.202004803

مصطلحات موضوعية: info:eu-repo/classification/ddc/530

جغرافية الموضوع: DE

Relation: info:eu-repo/semantics/altIdentifier/issn/1057-9257; info:eu-repo/semantics/altIdentifier/issn/1099-0712; info:eu-repo/semantics/altIdentifier/issn/1616-3028; info:eu-repo/semantics/altIdentifier/issn/1616-301X; info:eu-repo/semantics/altIdentifier/wos/WOS:000573010600001; https://publications.rwth-aachen.de/record/804408; https://publications.rwth-aachen.de/search?p=id:%22RWTH-2020-10253%22

الاتاحة: https://publications.rwth-aachen.de/record/804408
https://publications.rwth-aachen.de/search?p=id:%22RWTH-2020-10253%22