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Eva Zurek
Eva Zurek
Professor Department of Chemistry
Bestätigte E-Mail-Adresse bei buffalo.edu - Startseite
Titel
Zitiert von
Zitiert von
Jahr
Avogadro: an advanced semantic chemical editor, visualization, and analysis platform
MD Hanwell, DE Curtis, DC Lonie, T Vandermeersch, E Zurek, ...
Journal of cheminformatics 4, 1-17, 2012
100752012
XtalOpt: An open-source evolutionary algorithm for crystal structure prediction
DC Lonie, E Zurek
Computer Physics Communications 182 (2), 372-387, 2011
3882011
A little bit of lithium does a lot for hydrogen
E Zurek, R Hoffmann, NW Ashcroft, AR Oganov, AO Lyakhov
Proceedings of the National Academy of Sciences 106 (42), 17640-17643, 2009
3302009
Synthesis of yttrium superhydride superconductor with a transition temperature up to 262 K by catalytic hydrogenation at high pressures
E Snider, N Dasenbrock-Gammon, R McBride, X Wang, N Meyers, ...
arXiv preprint arXiv:2012.13627, 2020
2702020
Theoretical studies of the structure and function of MAO (methylaluminoxane)
E Zurek, T Ziegler
Progress in polymer science 29 (2), 107-148, 2004
2352004
The 2021 room-temperature superconductivity roadmap
B Lilia, R Hennig, P Hirschfeld, G Profeta, A Sanna, E Zurek, WE Pickett, ...
Journal of Physics: Condensed Matter 34 (18), 183002, 2022
2112022
Graphene-like boron–carbon–nitrogen monolayers
S Beniwal, J Hooper, DP Miller, PS Costa, G Chen, SY Liu, PA Dowben, ...
ACS nano 11 (3), 2486-2493, 2017
1962017
A molecular perspective on lithium–ammonia solutions
E Zurek, PP Edwards, R Hoffmann
Angewandte Chemie International Edition 48 (44), 8198-8232, 2009
1952009
Chemistry under high pressure
M Miao, Y Sun, E Zurek, H Lin
Nature Reviews Chemistry 4 (10), 508-527, 2020
1882020
Density functional calculations of the 13C NMR chemical shifts in (9, 0) single-walled carbon nanotubes
E Zurek, J Autschbach
Journal of the American Chemical Society 126 (40), 13079-13088, 2004
1822004
High-temperature superconductivity in alkaline and rare earth polyhydrides at high pressure: A theoretical perspective
E Zurek, T Bi
The Journal of chemical physics 150 (5), 2019
1742019
Route to high- superconductivity via -intercalated hydride perovskites
W Cui, T Bi, J Shi, Y Li, H Liu, E Zurek, RJ Hemley
Physical Review B 101 (13), 134504, 2020
1442020
Metallization of magnesium polyhydrides under pressure
DC Lonie, J Hooper, B Altintas, E Zurek
Physical Review B—Condensed Matter and Materials Physics 87 (5), 054107, 2013
1392013
Predicting crystal structures and properties of matter under extreme conditions via quantum mechanics: the pressure is on
E Zurek, W Grochala
Physical Chemistry Chemical Physics 17 (5), 2917-2934, 2015
1362015
Pressure-Stabilized Sodium Polyhydrides: ()
P Baettig, E Zurek
Physical Review Letters 106 (23), 237002, 2011
1252011
Decomposition Products of Phosphine Under Pressure: PH2 Stable and Superconducting?
A Shamp, T Terpstra, T Bi, Z Falls, P Avery, E Zurek
Journal of the American Chemical Society 138 (6), 1884-1892, 2016
1232016
Modeling the Dynamic Equilibrium between Oligomers of (AlOCH3)n in Methylaluminoxane (MAO). A Theoretical Study Based on a Combined Quantum …
E Zurek, TK Woo, TK Firman, T Ziegler
Inorganic Chemistry 40 (2), 361-370, 2001
1232001
AFLOW-ML: A RESTful API for machine-learning predictions of materials properties
E Gossett, C Toher, C Oses, O Isayev, F Legrain, F Rose, E Zurek, ...
Computational Materials Science 152, 134-145, 2018
1092018
Enantioselective Copper‐Catalyzed Carboetherification of Unactivated Alkenes
MT Bovino, TW Liwosz, NE Kendel, Y Miller, N Tyminska, E Zurek, ...
Angewandte Chemie 126 (25), 6501-6505, 2014
1082014
Theoretical study of the interactions between cations and anions in group IV transition-metal catalysts for single-site homogeneous olefin polymerization
Z Xu, K Vanka, T Firman, A Michalak, E Zurek, C Zhu, T Ziegler
Organometallics 21 (12), 2444-2453, 2002
1082002
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