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Nature Materials
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May 5, 2026
Guiding sulfur without crystallizing it
Sebastian Risse, Pouya Partovi-Azar
Journal of Computational Chemistry
|
January 20, 2017
Time-dependent density functional theory study on direction-dependent electron and hole transfer processes in molecular systems
Pouya Partovi-Azar, Payam Kaghazchi
The Journal of Chemical Physics
|
February 17, 2020
Optimized effective potentials to increase the accuracy of approximate proton transfer energy calculations in the excited state
Pouya Partovi-Azar, Daniel Sebastiani
Micromachines
|
July 2, 2021
Minimal Optimized Effective Potentials for Density Functional Theory Studies on Excited-State Proton Dissociation
Pouya Partovi-Azar, Daniel Sebastiani
Micromachines
|
October 23, 2021
Full Assignment of Ab-Initio Raman Spectra at Finite Temperatures Using Wannier Polarizabilities: Application to Cyclohexane Molecule in Gas Phase
Pouya Partovi-Azar, Thomas D Kühne
Journal of Computational Chemistry
|
September 25, 2015
Efficient "on-the-fly" calculation of Raman spectra from ab-initio molecular dynamics: Application to hydrophobic/hydrophilic solutes in bulk water
Pouya Partovi-Azar, Thomas D Kühne
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry
|
September 29, 2021
On the Structure of Sulfur/1,3-Diisopropenylbenzene Co-Polymer Cathodes for Li-S Batteries: Insights from Density-Functional Theory Calculations
Rana Kiani, Daniel Sebastiani, Pouya Partovi-Azar
Physical Chemistry Chemical Physics : PCCP
|
August 4, 2015
Evidence for the existence of Li2S2 clusters in lithium-sulfur batteries: ab initio Raman spectroscopy simulation
Pouya Partovi-Azar, Thomas D Kühne, Payam Kaghazchi
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry
|
July 10, 2019
In silico Complexes of Amino Acids and Diamondoids
Pouya Partovi-Azar, Chandra Shekar Sarap, Maria Fyta
RSC Advances
|
September 20, 2023
Characterization of sulfur/carbon copolymer cathodes for Li-S batteries: a combined experimental and <i>ab initio</i> Raman spectroscopy study
Rana Kiani, Matthias Steimecke, Marah Alqaisi, et al.
Page
of 2
Search research articles
Search
Showing results (1-10 of 14) with videos related to
Sort By:
Page
of 2
Nature Materials
|
May 5, 2026
Guiding sulfur without crystallizing it
Sebastian Risse, Pouya Partovi-Azar
Journal of Computational Chemistry
|
January 20, 2017
Time-dependent density functional theory study on direction-dependent electron and hole transfer processes in molecular systems
Pouya Partovi-Azar, Payam Kaghazchi
The Journal of Chemical Physics
|
February 17, 2020
Optimized effective potentials to increase the accuracy of approximate proton transfer energy calculations in the excited state
Pouya Partovi-Azar, Daniel Sebastiani
Micromachines
|
July 2, 2021
Minimal Optimized Effective Potentials for Density Functional Theory Studies on Excited-State Proton Dissociation
Pouya Partovi-Azar, Daniel Sebastiani
Micromachines
|
October 23, 2021
Full Assignment of Ab-Initio Raman Spectra at Finite Temperatures Using Wannier Polarizabilities: Application to Cyclohexane Molecule in Gas Phase
Pouya Partovi-Azar, Thomas D Kühne
Journal of Computational Chemistry
|
September 25, 2015
Efficient "on-the-fly" calculation of Raman spectra from ab-initio molecular dynamics: Application to hydrophobic/hydrophilic solutes in bulk water
Pouya Partovi-Azar, Thomas D Kühne
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry
|
September 29, 2021
On the Structure of Sulfur/1,3-Diisopropenylbenzene Co-Polymer Cathodes for Li-S Batteries: Insights from Density-Functional Theory Calculations
Rana Kiani, Daniel Sebastiani, Pouya Partovi-Azar
Physical Chemistry Chemical Physics : PCCP
|
August 4, 2015
Evidence for the existence of Li2S2 clusters in lithium-sulfur batteries: ab initio Raman spectroscopy simulation
Pouya Partovi-Azar, Thomas D Kühne, Payam Kaghazchi
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry
|
July 10, 2019
In silico Complexes of Amino Acids and Diamondoids
Pouya Partovi-Azar, Chandra Shekar Sarap, Maria Fyta
RSC Advances
|
September 20, 2023
Characterization of sulfur/carbon copolymer cathodes for Li-S batteries: a combined experimental and <i>ab initio</i> Raman spectroscopy study
Rana Kiani, Matthias Steimecke, Marah Alqaisi, et al.
Page
of 2