Search research articles
Contact Us
Filters
Showing results (11-20 of 67) with videos related to
Page
of 7
Sort By:
The Journal of Chemical Physics
|
October 23, 2021
All-electron real-time and imaginary-time time-dependent density functional theory within a numeric atom-centered basis function framework
Joscha Hekele, Yi Yao, Yosuke Kanai, et al.
Physical Review Letters
|
April 8, 2011
Unraveling the stability of polypeptide helices: critical role of van der Waals interactions
Alexandre Tkatchenko, Mariana Rossi, Volker Blum, et al.
Journal of Chemical Theory and Computation
|
February 9, 2022
All-Electron BSE@<i>GW</i> Method for <i>K</i>-Edge Core Electron Excitation Energies
Yi Yao, Dorothea Golze, Patrick Rinke, et al.
Journal of Chemical Theory and Computation
|
January 14, 2025
All-Electron BSE@GW Method with Numeric Atom-Centered Orbitals for Extended Periodic Systems
Ruiyi Zhou, Yi Yao, Volker Blum, et al.
Inorganic Chemistry
|
February 2, 2022
Cubic Crystal Structure Formation and Optical Properties within the Ag-B<sup>II</sup>-M<sup>IV</sup>-X (B<sup>II</sup> = Sr, Pb; M<sup>IV</sup> = Si, Ge, Sn; X = S, Se) Family of Semiconductors
Garrett C McKeown Wessler, Tianlin Wang, Volker Blum, et al.
Journal of the American Chemical Society
|
February 24, 2026
Local Symmetry Breaking in 3D Hybrid Perovskites with 3-Hydroxyazetidinium
Rayan Chakraborty, Benjamin Bobay, Xixi Qin, et al.
The Journal of Chemical Physics
|
April 17, 2020
Frenkel-Holstein Hamiltonian applied to absorption spectra of quaterthiophene-based 2D hybrid organic-inorganic perovskites
Svenja M Janke, Mohammad B Qarai, Volker Blum, et al.
Nature Materials
|
April 19, 2005
Evolutionary approach for determining first-principles hamiltonians
Gus L W Hart, Volker Blum, Michael J Walorski, et al.
Journal of the American Chemical Society
|
December 4, 2024
Design of Two-Dimensional Hybrid Perovskites with Giant Spin Splitting and Persistent Spin Textures
Rayan Chakraborty, Peter C Sercel, Xixi Qin, et al.
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry
|
September 22, 2021
Density Functional Theory Study of Reaction Equilibria in Signal Amplification by Reversible Exchange
Kailai Lin, Patrick TomHon, Sören Lehmkuhl, et al.
Page
of 7
Search research articles
Search
Showing results (11-20 of 67) with videos related to
Sort By:
Page
of 7
The Journal of Chemical Physics
|
October 23, 2021
All-electron real-time and imaginary-time time-dependent density functional theory within a numeric atom-centered basis function framework
Joscha Hekele, Yi Yao, Yosuke Kanai, et al.
Physical Review Letters
|
April 8, 2011
Unraveling the stability of polypeptide helices: critical role of van der Waals interactions
Alexandre Tkatchenko, Mariana Rossi, Volker Blum, et al.
Journal of Chemical Theory and Computation
|
February 9, 2022
All-Electron BSE@<i>GW</i> Method for <i>K</i>-Edge Core Electron Excitation Energies
Yi Yao, Dorothea Golze, Patrick Rinke, et al.
Journal of Chemical Theory and Computation
|
January 14, 2025
All-Electron BSE@GW Method with Numeric Atom-Centered Orbitals for Extended Periodic Systems
Ruiyi Zhou, Yi Yao, Volker Blum, et al.
Inorganic Chemistry
|
February 2, 2022
Cubic Crystal Structure Formation and Optical Properties within the Ag-B<sup>II</sup>-M<sup>IV</sup>-X (B<sup>II</sup> = Sr, Pb; M<sup>IV</sup> = Si, Ge, Sn; X = S, Se) Family of Semiconductors
Garrett C McKeown Wessler, Tianlin Wang, Volker Blum, et al.
Journal of the American Chemical Society
|
February 24, 2026
Local Symmetry Breaking in 3D Hybrid Perovskites with 3-Hydroxyazetidinium
Rayan Chakraborty, Benjamin Bobay, Xixi Qin, et al.
The Journal of Chemical Physics
|
April 17, 2020
Frenkel-Holstein Hamiltonian applied to absorption spectra of quaterthiophene-based 2D hybrid organic-inorganic perovskites
Svenja M Janke, Mohammad B Qarai, Volker Blum, et al.
Nature Materials
|
April 19, 2005
Evolutionary approach for determining first-principles hamiltonians
Gus L W Hart, Volker Blum, Michael J Walorski, et al.
Journal of the American Chemical Society
|
December 4, 2024
Design of Two-Dimensional Hybrid Perovskites with Giant Spin Splitting and Persistent Spin Textures
Rayan Chakraborty, Peter C Sercel, Xixi Qin, et al.
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry
|
September 22, 2021
Density Functional Theory Study of Reaction Equilibria in Signal Amplification by Reversible Exchange
Kailai Lin, Patrick TomHon, Sören Lehmkuhl, et al.
Page
of 7