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Physical Chemistry Chemical Physics : PCCP
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September 30, 2021
Modelling of high-temperature order-disorder phase transitions of non-stoichiometric Mo<sub>2</sub>C and Ti<sub>2</sub>C from first principles
Ignacio Borge-Durán, Denial Aias, Ilya Grinberg
Advanced Materials (Deerfield Beach, Fla.)
|
November 23, 2021
A Multilevel Analytical Theory for Prediction of Ferroelectric Perovskite Oxide Properties from Composition
Suhas Yadav, Atanu Samanta, Or Shafir, et al.
Nature
|
November 1, 2002
Relationship between local structure and phase transitions of a disordered solid solution
Ilya Grinberg, Valentino R Cooper, Andrew M Rappe
Physical Review Letters
|
May 16, 2007
Polarization effects on the surface chemistry of PbTiO3-supported Pt films
Alexie M Kolpak, Ilya Grinberg, Andrew M Rappe
The Journal of Physical Chemistry. B
|
February 24, 2006
Adsorbate-adsorbate interactions and chemisorption at different coverages studied by accurate ab initio calculations: CO on transition metal surfaces
Sara E Mason, Ilya Grinberg, Andrew M Rappe
Journal of the American Chemical Society
|
December 5, 2008
New highly polar semiconductor ferroelectrics through d8 cation-O vacancy substitution into PbTiO3: a theoretical study
Joseph W Bennett, Ilya Grinberg, Andrew M Rappe
Proceedings of the National Academy of Sciences of the United States of America
|
July 1, 2017
Getting a charge out of hybrid perovskites
Andrew M Rappe, Ilya Grinberg, Jonathan E Spanier
Journal of Chemical Information and Modeling
|
November 20, 2023
Identification of High-Reliability Regions of Machine Learning Predictions Based on Materials Chemistry
Evan M Askenazi, Emanuel A Lazar, Ilya Grinberg
Physical Review Letters
|
April 7, 2010
Molecular dynamics study of dielectric response in a relaxor ferroelectric
Ilya Grinberg, Young-Han Shin, Andrew M Rappe
The Journal of Physical Chemistry Letters
|
January 8, 2024
Identification of a Durability Descriptor for Molecular Oxygen Reduction Reaction Catalysts
Nagaprasad Reddy Samala, Ariel Friedman, Lior Elbaz, et al.
Page
of 6
Search research articles
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Showing results (11-20 of 51) with videos related to
Sort By:
Page
of 6
Physical Chemistry Chemical Physics : PCCP
|
September 30, 2021
Modelling of high-temperature order-disorder phase transitions of non-stoichiometric Mo<sub>2</sub>C and Ti<sub>2</sub>C from first principles
Ignacio Borge-Durán, Denial Aias, Ilya Grinberg
Advanced Materials (Deerfield Beach, Fla.)
|
November 23, 2021
A Multilevel Analytical Theory for Prediction of Ferroelectric Perovskite Oxide Properties from Composition
Suhas Yadav, Atanu Samanta, Or Shafir, et al.
Nature
|
November 1, 2002
Relationship between local structure and phase transitions of a disordered solid solution
Ilya Grinberg, Valentino R Cooper, Andrew M Rappe
Physical Review Letters
|
May 16, 2007
Polarization effects on the surface chemistry of PbTiO3-supported Pt films
Alexie M Kolpak, Ilya Grinberg, Andrew M Rappe
The Journal of Physical Chemistry. B
|
February 24, 2006
Adsorbate-adsorbate interactions and chemisorption at different coverages studied by accurate ab initio calculations: CO on transition metal surfaces
Sara E Mason, Ilya Grinberg, Andrew M Rappe
Journal of the American Chemical Society
|
December 5, 2008
New highly polar semiconductor ferroelectrics through d8 cation-O vacancy substitution into PbTiO3: a theoretical study
Joseph W Bennett, Ilya Grinberg, Andrew M Rappe
Proceedings of the National Academy of Sciences of the United States of America
|
July 1, 2017
Getting a charge out of hybrid perovskites
Andrew M Rappe, Ilya Grinberg, Jonathan E Spanier
Journal of Chemical Information and Modeling
|
November 20, 2023
Identification of High-Reliability Regions of Machine Learning Predictions Based on Materials Chemistry
Evan M Askenazi, Emanuel A Lazar, Ilya Grinberg
Physical Review Letters
|
April 7, 2010
Molecular dynamics study of dielectric response in a relaxor ferroelectric
Ilya Grinberg, Young-Han Shin, Andrew M Rappe
The Journal of Physical Chemistry Letters
|
January 8, 2024
Identification of a Durability Descriptor for Molecular Oxygen Reduction Reaction Catalysts
Nagaprasad Reddy Samala, Ariel Friedman, Lior Elbaz, et al.
Page
of 6