日期:
2020 年 — 2026 年
2020
2021
2022
2023
2024
2025
2026
影响因子:

Developments and applications of the OPTIMADE API for materials discovery, design, and data exchange

OPTIMADE API在材料发现、设计和数据交换方面的开发和应用

Evans, Matthew L; Bergsma, Johan; Merkys, Andrius; Andersen, Casper W; Andersson, Oskar B; Beltrán, Daniel; Blokhin, Evgeny; Boland, Tara M; Castañeda Balderas, Rubén; Choudhary, Kamal; Díaz Díaz, Alberto; Domínguez García, Rodrigo; Eckert, Hagen; Eimre, Kristjan; Fuentes Montero, María Elena; Krajewski, Adam M; Mortensen, Jens Jørgen; Nápoles Duarte, José Manuel; Pietryga, Jacob; Qi, Ji; Trejo Carrillo, Felipe de Jesús; Vaitkus, Antanas; Yu, Jusong; Zettel, Adam; de Castro, Pedro Baptista; Carlsson, Johan; Cerqueira, Tiago F T; Divilov, Simon; Hajiyani, Hamidreza; Hanke, Felix; Jose, Kevin; Oses, Corey; Riebesell, Janosh; Schmidt, Jonathan; Winston, Donald; Xie, Christen; Yang, Xiaoyu; Bonella, Sara; Botti, Silvana; Curtarolo, Stefano; Draxl, Claudia; Fuentes Cobas, Luis Edmundo; Hospital, Adam; Liu, Zi-Kui; Marques, Miguel A L; Marzari, Nicola; Morris, Andrew J; Ong, Shyue Ping; Orozco, Modesto; Persson, Kristin A; Thygesen, Kristian S; Wolverton, Chris; Scheidgen, Markus; Toher, Cormac; Conduit, Gareth J; Pizzi, Giovanni; Gražulis, Saulius; Rignanese, Gian-Marco; Armiento, Rickard

Novel Oral Polio Vaccine Type 2 Use for Polio Outbreak Response: A Global Effort for a Global Health Emergency

新型口服脊髓灰质炎疫苗2型用于应对脊髓灰质炎疫情:全球应对全球卫生紧急事件的共同努力

Kurji, Feyrouz Damji; Bandyopadhyay, Ananda Sankar; Zipursky, Simona; Cooper, Laura V; Gast, Chris; Toher, Margaret; Clemens, Ralf; Clemens, Sue Ann Costa; Prasad, Rayasam; Azhari, Adriansjah

Plasmonic high-entropy carbides

等离子体高熵碳化物

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

Settling the matter of the role of vibrations in the stability of high-entropy carbides

确定振动在高熵碳化物稳定性中的作用问题

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

OPTIMADE, an API for exchanging materials data

OPTIMADE,一个用于交换材料数据的API

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

On-the-fly closed-loop materials discovery via Bayesian active learning

通过贝叶斯主动学习实现即时闭环材料发现

Kusne, A Gilad; Yu, Heshan; Wu, Changming; Zhang, Huairuo; Hattrick-Simpers, Jason; DeCost, Brian; Sarker, Suchismita; Oses, Corey; Toher, Cormac; Curtarolo, Stefano; Davydov, Albert V; Agarwal, Ritesh; Bendersky, Leonid A; Li, Mo; Mehta, Apurva; Takeuchi, Ichiro

High-entropy high-hardness metal carbides discovered by entropy descriptors

利用熵描述符发现高熵高硬度金属碳化物

Sarker, Pranab; Harrington, Tyler; Toher, Cormac; Oses, Corey; Samiee, Mojtaba; Maria, Jon-Paul; Brenner, Donald W; Vecchio, Kenneth S; Curtarolo, Stefano

Universal fragment descriptors for predicting properties of inorganic crystals

用于预测无机晶体性质的通用片段描述符

Isayev, Olexandr; Oses, Corey; Toher, Cormac; Gossett, Eric; Curtarolo, Stefano; Tropsha, Alexander

Spectral descriptors for bulk metallic glasses based on the thermodynamics of competing crystalline phases

基于竞争晶相热力学的块状金属玻璃光谱描述符

Perim, Eric; Lee, Dongwoo; Liu, Yanhui; Toher, Cormac; Gong, Pan; Li, Yanglin; Simmons, W Neal; Levy, Ohad; Vlassak, Joost J; Schroers, Jan; Curtarolo, Stefano

Infrared spectroscopic studies of cells and tissues: triple helix proteins as a potential biomarker for tumors

细胞和组织的红外光谱研究:三螺旋蛋白作为肿瘤的潜在生物标志物

Allison L Stelling, Deirdre Toher, Ortrud Uckermann, Jelena Tavkin, Elke Leipnitz, Julia Schweizer, Holger Cramm, Gerald Steiner, Kathrin D Geiger, Matthias Kirsch