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Journal of Chemical Theory and Computation
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October 21, 2022
Analytic Linear Vibronic Coupling Method for First-Principles Spin-Dynamics Calculations in Single-Molecule Magnets
Jakob K Staab, Nicholas F Chilton
Physical Chemistry Chemical Physics : PCCP
|
June 17, 2024
Intramolecular bridging strategies to suppress two-phonon Raman spin relaxation in dysprosocenium single-molecule magnets
Jakob K Staab, Md Kholilur Rahman, Nicholas F Chilton
Journal of Chemical Theory and Computation
|
May 15, 2025
Correction to "Approximate Hamiltonians from a Linear Vibronic Coupling Model for Solution-Phase Spin Dynamics"
Toby R C Thompson, Jakob K Staab, Nicholas F Chilton
Journal of Chemical Theory and Computation
|
January 17, 2025
Approximate Hamiltonians from a Linear Vibronic Coupling Model for Solution-Phase Spin Dynamics
Toby R C Thompson, Jakob K Staab, Nicholas F Chilton
Journal of the American Chemical Society
|
April 12, 2023
Taming Super-Reduced Bi<sub>2</sub><sup>3-</sup> Radicals with Rare Earth Cations
Peng Zhang, Rizwan Nabi, Jakob K Staab, et al.
Chemical Science
|
January 22, 2026
Deciphering the molecular origin of the 19.3 eV electronic excitation energy of H<sub>3</sub><sup></sup>
Josene M Toldo, Jakob K Staab, Eduard Matito, et al.
Chemical Science
|
February 19, 2026
Correction: Deciphering the molecular origin of the 19.3 eV electronic excitation energy of H<sub>3</sub><sup></sup>
Josene M Toldo, Jakob K Staab, Eduard Matito, et al.
Chemical Communications (Cambridge, England)
|
November 6, 2024
The impact of low-energy phonon lifetimes on the magnetic relaxation in a dysprosocenium single-molecule magnet
Rizwan Nabi, Benjamin E Atkinson, Jakob K Staab, et al.
Journal of the American Chemical Society
|
June 20, 2025
Correction to "Ab Initio Design of Molecular Qubits with Electric Field Control"
William T Morrillo, Herbert I J Cumming, Andrea Mattioni, et al.
Journal of the American Chemical Society
|
September 5, 2024
Ab Initio Design of Molecular Qubits with Electric Field Control
William T Morrillo, Herbert I J Cumming, Andrea Mattioni, et al.
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Search research articles
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Showing results (1-10 of 17) with videos related to
Sort By:
Page
of 2
Journal of Chemical Theory and Computation
|
October 21, 2022
Analytic Linear Vibronic Coupling Method for First-Principles Spin-Dynamics Calculations in Single-Molecule Magnets
Jakob K Staab, Nicholas F Chilton
Physical Chemistry Chemical Physics : PCCP
|
June 17, 2024
Intramolecular bridging strategies to suppress two-phonon Raman spin relaxation in dysprosocenium single-molecule magnets
Jakob K Staab, Md Kholilur Rahman, Nicholas F Chilton
Journal of Chemical Theory and Computation
|
May 15, 2025
Correction to "Approximate Hamiltonians from a Linear Vibronic Coupling Model for Solution-Phase Spin Dynamics"
Toby R C Thompson, Jakob K Staab, Nicholas F Chilton
Journal of Chemical Theory and Computation
|
January 17, 2025
Approximate Hamiltonians from a Linear Vibronic Coupling Model for Solution-Phase Spin Dynamics
Toby R C Thompson, Jakob K Staab, Nicholas F Chilton
Journal of the American Chemical Society
|
April 12, 2023
Taming Super-Reduced Bi<sub>2</sub><sup>3-</sup> Radicals with Rare Earth Cations
Peng Zhang, Rizwan Nabi, Jakob K Staab, et al.
Chemical Science
|
January 22, 2026
Deciphering the molecular origin of the 19.3 eV electronic excitation energy of H<sub>3</sub><sup></sup>
Josene M Toldo, Jakob K Staab, Eduard Matito, et al.
Chemical Science
|
February 19, 2026
Correction: Deciphering the molecular origin of the 19.3 eV electronic excitation energy of H<sub>3</sub><sup></sup>
Josene M Toldo, Jakob K Staab, Eduard Matito, et al.
Chemical Communications (Cambridge, England)
|
November 6, 2024
The impact of low-energy phonon lifetimes on the magnetic relaxation in a dysprosocenium single-molecule magnet
Rizwan Nabi, Benjamin E Atkinson, Jakob K Staab, et al.
Journal of the American Chemical Society
|
June 20, 2025
Correction to "Ab Initio Design of Molecular Qubits with Electric Field Control"
William T Morrillo, Herbert I J Cumming, Andrea Mattioni, et al.
Journal of the American Chemical Society
|
September 5, 2024
Ab Initio Design of Molecular Qubits with Electric Field Control
William T Morrillo, Herbert I J Cumming, Andrea Mattioni, et al.
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of 2