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Sergei Manzhos

Showing results (1-10 of 86) with videos related to

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Molecules (Basel, Switzerland)|May 14, 2020
Aggregate-State Effects in the Atomistic Modeling of Organic Materials for Electrochemical Energy Conversion and Storage Devices: A PerspectiveSergei Manzhos
Molecules (Basel, Switzerland)|November 16, 2016
Special Issue "Molecular Engineering for Electrochemical Power Sources"Sergei Manzhos
The Journal of Chemical Physics|December 17, 2008
Using neural networks, optimized coordinates, and high-dimensional model representations to obtain a vinyl bromide potential surfaceSergei Manzhos, Tucker Carrington
Physical Chemistry Chemical Physics : PCCP|May 11, 2022
Computational vibrational spectroscopy of molecule-surface interactions: what is still difficult and what can be done about itSergei Manzhos, Manabu Ihara
The Journal of Physical Chemistry Letters|August 10, 2017
Addition to "On the Charge State of Titanium in Titanium Dioxide"Daniel Koch, Sergei Manzhos
Physical Chemistry Chemical Physics : PCCP|December 15, 2015
A computational study of lithium interaction with tetracyanoethylene (TCNE) and tetracyaniquinodimethane (TCNQ) moleculesYingqian Chen, Sergei Manzhos
The Journal of Chemical Physics|December 4, 2018
Using rectangular collocation with finite difference derivatives to solve electronic Schrödinger equationSergei Manzhos, Tucker Carrington
The Journal of Chemical Physics|July 14, 2007
Using redundant coordinates to represent potential energy surfaces with lower-dimensional functionsSergei Manzhos, Tucker Carrington
Frontiers in Chemistry|March 11, 2020
First-Principle Insights Into Molecular Design for High-Voltage Organic Electrode Materials for Mg Based BatteriesJohann Lüder, Sergei Manzhos
The Journal of Chemical Physics|August 24, 2020
Data-driven kinetic energy density fitting for orbital-free DFT: Linear vs Gaussian process regressionSergei Manzhos, Pavlo Golub
Pageof 9

Showing results (1-10 of 86) with videos related to

Sort By:
Pageof 9
Molecules (Basel, Switzerland)|May 14, 2020
Aggregate-State Effects in the Atomistic Modeling of Organic Materials for Electrochemical Energy Conversion and Storage Devices: A PerspectiveSergei Manzhos
Molecules (Basel, Switzerland)|November 16, 2016
Special Issue "Molecular Engineering for Electrochemical Power Sources"Sergei Manzhos
The Journal of Chemical Physics|December 17, 2008
Using neural networks, optimized coordinates, and high-dimensional model representations to obtain a vinyl bromide potential surfaceSergei Manzhos, Tucker Carrington
Physical Chemistry Chemical Physics : PCCP|May 11, 2022
Computational vibrational spectroscopy of molecule-surface interactions: what is still difficult and what can be done about itSergei Manzhos, Manabu Ihara
The Journal of Physical Chemistry Letters|August 10, 2017
Addition to "On the Charge State of Titanium in Titanium Dioxide"Daniel Koch, Sergei Manzhos
Physical Chemistry Chemical Physics : PCCP|December 15, 2015
A computational study of lithium interaction with tetracyanoethylene (TCNE) and tetracyaniquinodimethane (TCNQ) moleculesYingqian Chen, Sergei Manzhos
The Journal of Chemical Physics|December 4, 2018
Using rectangular collocation with finite difference derivatives to solve electronic Schrödinger equationSergei Manzhos, Tucker Carrington
The Journal of Chemical Physics|July 14, 2007
Using redundant coordinates to represent potential energy surfaces with lower-dimensional functionsSergei Manzhos, Tucker Carrington
Frontiers in Chemistry|March 11, 2020
First-Principle Insights Into Molecular Design for High-Voltage Organic Electrode Materials for Mg Based BatteriesJohann Lüder, Sergei Manzhos
The Journal of Chemical Physics|August 24, 2020
Data-driven kinetic energy density fitting for orbital-free DFT: Linear vs Gaussian process regressionSergei Manzhos, Pavlo Golub
Pageof 9