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Science (New York, N.Y.)
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January 27, 1989
Response: magnon-exchange pairing and superconductivity
G Chen, J M Langlois, Y Guo, et al.
Angewandte Chemie (International Ed. in English)
|
September 10, 2009
The ReaxFF Monte Carlo reactive dynamics method for predicting atomistic structures of disordered ceramics: application to the Mo(3)VO(x) catalyst
Kimberly Chenoweth, Adri C T van Duin, William A Goddard
The Journal of Physical Chemistry. A
|
December 23, 2011
High H2 uptake in Li-, Na-, K-metalated covalent organic frameworks and metal organic frameworks at 298 K
José L Mendoza-Cortés, Sang Soo Han, William A Goddard
Proceedings of the National Academy of Sciences of the United States of America
|
November 25, 2011
A fast doubly hybrid density functional method close to chemical accuracy using a local opposite spin ansatz
Igor Ying Zhang, Xin Xu, Yousung Jung, et al.
The Journal of Physical Chemistry. A
|
January 17, 2008
ReaxFF reactive force field for molecular dynamics simulations of hydrocarbon oxidation
Kimberly Chenoweth, Adri C T van Duin, William A Goddard
Physical Chemistry Chemical Physics : PCCP
|
January 11, 2018
The importance of grand-canonical quantum mechanical methods to describe the effect of electrode potential on the stability of intermediates involved in both electrochemical CO<sub>2</sub> reduction and hydrogen evolution
Haochen Zhang, William A Goddard, Qi Lu, et al.
The Journal of Physical Chemistry. A
|
March 15, 2012
Development of a ReaxFF reactive force field for ettringite and study of its mechanical failure modes from reactive dynamics simulations
Lianchi Liu, Andres Jaramillo-Botero, William A Goddard, et al.
Journal of Agricultural and Food Chemistry
|
October 6, 2021
Synergic Effects in the Activation of the Sweet Receptor GPCR Heterodimer for Various Sweeteners Predicted Using Molecular Metadynamics Simulations
Jaewan Jang, Soo-Kyung Kim, Brian Guthrie, et al.
The Journal of Physical Chemistry. A
|
November 10, 2018
Polarizable Charge Equilibration Model for Transition-Metal Elements
Soonho Kwon, Saber Naserifar, Hyuck Mo Lee, et al.
The Journal of Physical Chemistry Letters
|
November 29, 2022
Phosphine Modulation for Enhanced CO<sub>2</sub> Capture: Quantum Mechanics Predictions of New Materials
Charles B Musgrave Iii, Aleksandrs Prokofjevs, William A Goddard Iii
Page
of 107
Search research articles
Search
Showing results (281-290 of 1,063) with videos related to
Sort By:
Page
of 107
Science (New York, N.Y.)
|
January 27, 1989
Response: magnon-exchange pairing and superconductivity
G Chen, J M Langlois, Y Guo, et al.
Angewandte Chemie (International Ed. in English)
|
September 10, 2009
The ReaxFF Monte Carlo reactive dynamics method for predicting atomistic structures of disordered ceramics: application to the Mo(3)VO(x) catalyst
Kimberly Chenoweth, Adri C T van Duin, William A Goddard
The Journal of Physical Chemistry. A
|
December 23, 2011
High H2 uptake in Li-, Na-, K-metalated covalent organic frameworks and metal organic frameworks at 298 K
José L Mendoza-Cortés, Sang Soo Han, William A Goddard
Proceedings of the National Academy of Sciences of the United States of America
|
November 25, 2011
A fast doubly hybrid density functional method close to chemical accuracy using a local opposite spin ansatz
Igor Ying Zhang, Xin Xu, Yousung Jung, et al.
The Journal of Physical Chemistry. A
|
January 17, 2008
ReaxFF reactive force field for molecular dynamics simulations of hydrocarbon oxidation
Kimberly Chenoweth, Adri C T van Duin, William A Goddard
Physical Chemistry Chemical Physics : PCCP
|
January 11, 2018
The importance of grand-canonical quantum mechanical methods to describe the effect of electrode potential on the stability of intermediates involved in both electrochemical CO<sub>2</sub> reduction and hydrogen evolution
Haochen Zhang, William A Goddard, Qi Lu, et al.
The Journal of Physical Chemistry. A
|
March 15, 2012
Development of a ReaxFF reactive force field for ettringite and study of its mechanical failure modes from reactive dynamics simulations
Lianchi Liu, Andres Jaramillo-Botero, William A Goddard, et al.
Journal of Agricultural and Food Chemistry
|
October 6, 2021
Synergic Effects in the Activation of the Sweet Receptor GPCR Heterodimer for Various Sweeteners Predicted Using Molecular Metadynamics Simulations
Jaewan Jang, Soo-Kyung Kim, Brian Guthrie, et al.
The Journal of Physical Chemistry. A
|
November 10, 2018
Polarizable Charge Equilibration Model for Transition-Metal Elements
Soonho Kwon, Saber Naserifar, Hyuck Mo Lee, et al.
The Journal of Physical Chemistry Letters
|
November 29, 2022
Phosphine Modulation for Enhanced CO<sub>2</sub> Capture: Quantum Mechanics Predictions of New Materials
Charles B Musgrave Iii, Aleksandrs Prokofjevs, William A Goddard Iii
Page
of 107