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Accounts of Chemical Research
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December 27, 2018
Understanding and Quantifying London Dispersion Effects in Organometallic Complexes
Markus Bursch, Eike Caldeweyher, Andreas Hansen, et al.
Journal of Chemical Theory and Computation
|
November 18, 2015
Quantum chemical benchmark study on 46 RNA backbone families using a dinucleotide unit
Holger Kruse, Arnost Mladek, Konstantinos Gkionis, et al.
The Journal of Chemical Physics
|
October 12, 2018
Finding the best density functional approximation to describe interaction energies and structures of ionic liquids in molecular dynamics studies
Eva Perlt, Promit Ray, Andreas Hansen, et al.
Contact Dermatitis
|
April 12, 2023
Allergic contact dermatitis to accelerators in rubber gloves marketed as accelerator-free
Richard Brans, Silke Werner, Lara Obermeyer, et al.
The Journal of Physical Chemistry. B
|
April 11, 2020
Quantum Chemical Calculation of Molecular and Periodic Peptide and Protein Structures
Sarah Schmitz, Jakob Seibert, Katja Ostermeir, et al.
Physical Chemistry Chemical Physics : PCCP
|
April 4, 2025
Correction: The p-block challenge: assessing quantum chemistry methods for inorganic heterocycle dimerizations
Thomas Gasevic, Markus Bursch, Qianli Ma, et al.
Chemistryopen
|
December 6, 2014
The thermochemistry of london dispersion-driven transition metal reactions: getting the 'right answer for the right reason'
Andreas Hansen, Christoph Bannwarth, Stefan Grimme, et al.
Physical Chemistry Chemical Physics : PCCP
|
April 25, 2024
The p-block challenge: assessing quantum chemistry methods for inorganic heterocycle dimerizations
Thomas Gasevic, Markus Bursch, Qianli Ma, et al.
Chemistry (Weinheim an Der Bergstrasse, Germany)
|
April 19, 2012
Electronic structure analysis of the oxygen-activation mechanism by Fe(II)- and α-ketoglutarate (αKG)-dependent dioxygenases
Shengfa Ye, Christoph Riplinger, Andreas Hansen, et al.
Journal of the American Chemical Society
|
July 8, 2024
Pushing the Limits of Organometallic Redox Chemistry with an Isolable Mn(-I) Dianion
Ageliki Karagiannis, Hagen Neugebauer, Roger A Lalancette, et al.
Page
of 10
Search research articles
Search
Showing results (51-60 of 100) with videos related to
Sort By:
Page
of 10
Accounts of Chemical Research
|
December 27, 2018
Understanding and Quantifying London Dispersion Effects in Organometallic Complexes
Markus Bursch, Eike Caldeweyher, Andreas Hansen, et al.
Journal of Chemical Theory and Computation
|
November 18, 2015
Quantum chemical benchmark study on 46 RNA backbone families using a dinucleotide unit
Holger Kruse, Arnost Mladek, Konstantinos Gkionis, et al.
The Journal of Chemical Physics
|
October 12, 2018
Finding the best density functional approximation to describe interaction energies and structures of ionic liquids in molecular dynamics studies
Eva Perlt, Promit Ray, Andreas Hansen, et al.
Contact Dermatitis
|
April 12, 2023
Allergic contact dermatitis to accelerators in rubber gloves marketed as accelerator-free
Richard Brans, Silke Werner, Lara Obermeyer, et al.
The Journal of Physical Chemistry. B
|
April 11, 2020
Quantum Chemical Calculation of Molecular and Periodic Peptide and Protein Structures
Sarah Schmitz, Jakob Seibert, Katja Ostermeir, et al.
Physical Chemistry Chemical Physics : PCCP
|
April 4, 2025
Correction: The p-block challenge: assessing quantum chemistry methods for inorganic heterocycle dimerizations
Thomas Gasevic, Markus Bursch, Qianli Ma, et al.
Chemistryopen
|
December 6, 2014
The thermochemistry of london dispersion-driven transition metal reactions: getting the 'right answer for the right reason'
Andreas Hansen, Christoph Bannwarth, Stefan Grimme, et al.
Physical Chemistry Chemical Physics : PCCP
|
April 25, 2024
The p-block challenge: assessing quantum chemistry methods for inorganic heterocycle dimerizations
Thomas Gasevic, Markus Bursch, Qianli Ma, et al.
Chemistry (Weinheim an Der Bergstrasse, Germany)
|
April 19, 2012
Electronic structure analysis of the oxygen-activation mechanism by Fe(II)- and α-ketoglutarate (αKG)-dependent dioxygenases
Shengfa Ye, Christoph Riplinger, Andreas Hansen, et al.
Journal of the American Chemical Society
|
July 8, 2024
Pushing the Limits of Organometallic Redox Chemistry with an Isolable Mn(-I) Dianion
Ageliki Karagiannis, Hagen Neugebauer, Roger A Lalancette, et al.
Page
of 10