Zobrazeno 1 - 10
of 444
pro vyhledávání: '"Kevin M. Rosso"'
Publikováno v:
Nature Communications, Vol 15, Iss 1, Pp 1-12 (2024)
Abstract The interaction of condensed phase systems with external electric fields is of major importance in a myriad of processes in nature and technology, ranging from the field-directed motion of cells (galvanotaxis), to geochemistry and the format
Externí odkaz:
https://doaj.org/article/490413e1425f4a07a7de118b86dccecc
Autor:
Hsiu-Wen Wang, Emily T. Nienhuis, Trent R. Graham, Maxime Pouvreau, Jacob G. Reynolds, Mark Bowden, Gregory K. Schenter, James J. De Yoreo, Kevin M. Rosso, Carolyn I. Pearce
Publikováno v:
Communications Chemistry, Vol 7, Iss 1, Pp 1-10 (2024)
Abstract Aluminum hydroxide polymorphs are of widespread importance yet their kinetics of nucleation and growth remain beyond the reach of current models. Here we attempt to unveil the reaction processes underlying the polymorphs formation at high ch
Externí odkaz:
https://doaj.org/article/9503dc9abd68488981283a8d062bc470
Autor:
Guomin Zhu, Benjamin A. Legg, Michel Sassi, Xinran Liang, Meirong Zong, Kevin M. Rosso, James J. De Yoreo
Publikováno v:
Nature Communications, Vol 14, Iss 1, Pp 1-11 (2023)
Abstract Crystal dissolution, which is a fundamental process in both natural and technological settings, has been predominately viewed as a process of ion-by-ion detachment into a surrounding solvent. Here we report a mechanism of dissolution by part
Externí odkaz:
https://doaj.org/article/798d7b9a9c404d538f196ec88e249a19
Autor:
Duo Song, Nicholas P. Bauman, Guen Prawiroatmodjo, Bo Peng, Cassandra Granade, Kevin M. Rosso, Guang Hao Low, Martin Roetteler, Karol Kowalski, Eric J. Bylaska
Publikováno v:
Materials Theory, Vol 7, Iss 1, Pp 1-34 (2023)
Abstract A procedure for defining virtual spaces, and the periodic one-electron and two-electron integrals, for plane-wave second quantized Hamiltonians has been developed, and it was validated using full configuration interaction (FCI) calculations,
Externí odkaz:
https://doaj.org/article/f5a7e22e36f6434e92af80fb3a09fb63
Publikováno v:
Communications Chemistry, Vol 4, Iss 1, Pp 1-10 (2021)
Ferrihydrite is the most bioavailable source of ferric iron, but its variable structure and composition are poorly understood because of its small size and lack of ordering. Here ab initio thermodynamics reveals that ferrihydrite can be described as
Externí odkaz:
https://doaj.org/article/2732a447b9814456b71194d61d430cb1
Autor:
Shawn L. Riechers, Nikolay G. Petrik, John S. Loring, Mark E. Bowden, John B. Cliff, Mark K. Murphy, Carolyn I. Pearce, Greg A. Kimmel, Kevin M. Rosso
Publikováno v:
Communications Chemistry, Vol 4, Iss 1, Pp 1-7 (2021)
Halide salts exhibit complex radiation-induced reactions that are relevant in atmospheric chemistry, but detailed characterizations in high-level radiation fields are challenging to obtain. Here, the authors use a custom atomic force microscope to st
Externí odkaz:
https://doaj.org/article/958fda66e26645aa9133343a6d8d58d7
Autor:
Yifeng Zhu, Xin Zhang, Katherine Koh, Libor Kovarik, John L. Fulton, Kevin M. Rosso, Oliver Y. Gutiérrez
Publikováno v:
Nature Communications, Vol 11, Iss 1, Pp 1-7 (2020)
While typical catalysts involve oxide-supported metals, inverse catalysts of oxides on metal supports offer an attractive alternative. Here, authors prepare FeOx-coated Rh nanoparticles via galvanic replacement and dissolution-precipitation to form e
Externí odkaz:
https://doaj.org/article/f6f99ac0e60b46a5b39c7c6c1103555b
Publikováno v:
Materials Theory, Vol 4, Iss 1, Pp 1-31 (2020)
Abstract An efficient and accurate approach for calculating exact exchange and other two-electron integrals has been developed for periodic electronic structure methods. Traditional approaches used for integrating over the Brillouin zone in band stru
Externí odkaz:
https://doaj.org/article/6c34bb3787174550af6f895fa5d68331
Autor:
Haiping Jia, Xiaolin Li, Junhua Song, Xin Zhang, Langli Luo, Yang He, Binsong Li, Yun Cai, Shenyang Hu, Xingcheng Xiao, Chongmin Wang, Kevin M. Rosso, Ran Yi, Rajankumar Patel, Ji-Guang Zhang
Publikováno v:
Nature Communications, Vol 11, Iss 1, Pp 1-9 (2020)
The authors here construct hierarchical porous CNT@Si@C microspheres as anodes for Li-ion batteries, enabling both high electrochemical performance and excellent mechanical strength. The work highlights the importance of mechanical properties in deve
Externí odkaz:
https://doaj.org/article/150786d6786040e78b1f41ba1ed6c608
Publikováno v:
American Mineralogist. 108:1109-1116
Magnetic contributions have the potential to significantly influence predicted phase stability within alloy and mineral mixing phase diagrams, yet have been historically challenging to incorporate due to a significant increase to phase space sampling
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::d7056f40a7b52a89addf2d139385cf43
https://doi.org/10.2138/am-2022-8584
https://doi.org/10.2138/am-2022-8584