Search research articles
Contact Us
Filters
Showing results (51-60 of 357) with videos related to
Page
of 36
Sort By:
Chemistryopen
|
February 20, 2014
Density functional study of tetraphenylporphyrin long-range exciton coupling
Barry Moore, Jochen Autschbach
Journal of Chemical Theory and Computation
|
November 27, 2015
Modeling of the Chiroptical Response of Chiral Amino Acids in Solution Using Explicit Solvation and Molecular Dynamics
Matthew D Kundrat, Jochen Autschbach
Journal of Chemical Theory and Computation
|
September 22, 2021
Theoretical Prediction and Interpretation of <sup>237</sup>Np Mössbauer Isomer Shifts
Laura C Motta, Jochen Autschbach
Nature Communications
|
July 18, 2023
Actinide inverse trans influence versus cooperative pushing from below and multi-center bonding
Laura C Motta, Jochen Autschbach
The Journal of Physical Chemistry. A
|
July 13, 2006
Magnitude of zero-point vibrational corrections to optical rotation in rigid organic molecules: a time-dependent density functional study
Brendan C Mort, Jochen Autschbach
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry
|
January 3, 2023
Relativistic Density Functional NMR Tensors Analyzed with Spin-free Localized Molecular Orbitals
Alberto Fernández-Alarcón, Jochen Autschbach
Journal of the American Chemical Society
|
October 30, 2003
A theoretical study of the NMR spin-spin coupling constants of the complexes [(NC)(5)Pt-Tl(CN)(n)](n-) (n = 0-3) and [(NC)(5)Pt-Tl-Pt(CN)(5)](3-): a lesson on environmental effects
Jochen Autschbach, Boris Le Guennic
Annual Review of Physical Chemistry
|
May 3, 2017
Calculating Natural Optical Activity of Molecules from First Principles
Monika Srebro-Hooper, Jochen Autschbach
Journal of the American Chemical Society
|
March 12, 2008
Computational modeling of the optical rotation of amino acids: a new look at an old rule for pH dependence of optical rotation
Matthew D Kundrat, Jochen Autschbach
Chemical Science
|
April 13, 2022
Covalency in actinide(iv) hexachlorides in relation to the chlorine K-edge X-ray absorption structure
Dumitru-Claudiu Sergentu, Jochen Autschbach
Page
of 36
Search research articles
Search
Showing results (51-60 of 357) with videos related to
Sort By:
Page
of 36
Chemistryopen
|
February 20, 2014
Density functional study of tetraphenylporphyrin long-range exciton coupling
Barry Moore, Jochen Autschbach
Journal of Chemical Theory and Computation
|
November 27, 2015
Modeling of the Chiroptical Response of Chiral Amino Acids in Solution Using Explicit Solvation and Molecular Dynamics
Matthew D Kundrat, Jochen Autschbach
Journal of Chemical Theory and Computation
|
September 22, 2021
Theoretical Prediction and Interpretation of <sup>237</sup>Np Mössbauer Isomer Shifts
Laura C Motta, Jochen Autschbach
Nature Communications
|
July 18, 2023
Actinide inverse trans influence versus cooperative pushing from below and multi-center bonding
Laura C Motta, Jochen Autschbach
The Journal of Physical Chemistry. A
|
July 13, 2006
Magnitude of zero-point vibrational corrections to optical rotation in rigid organic molecules: a time-dependent density functional study
Brendan C Mort, Jochen Autschbach
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry
|
January 3, 2023
Relativistic Density Functional NMR Tensors Analyzed with Spin-free Localized Molecular Orbitals
Alberto Fernández-Alarcón, Jochen Autschbach
Journal of the American Chemical Society
|
October 30, 2003
A theoretical study of the NMR spin-spin coupling constants of the complexes [(NC)(5)Pt-Tl(CN)(n)](n-) (n = 0-3) and [(NC)(5)Pt-Tl-Pt(CN)(5)](3-): a lesson on environmental effects
Jochen Autschbach, Boris Le Guennic
Annual Review of Physical Chemistry
|
May 3, 2017
Calculating Natural Optical Activity of Molecules from First Principles
Monika Srebro-Hooper, Jochen Autschbach
Journal of the American Chemical Society
|
March 12, 2008
Computational modeling of the optical rotation of amino acids: a new look at an old rule for pH dependence of optical rotation
Matthew D Kundrat, Jochen Autschbach
Chemical Science
|
April 13, 2022
Covalency in actinide(iv) hexachlorides in relation to the chlorine K-edge X-ray absorption structure
Dumitru-Claudiu Sergentu, Jochen Autschbach
Page
of 36