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Chemical Science
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June 14, 2018
A universal chemical potential for sulfur vapours
Adam J Jackson, Davide Tiana, Aron Walsh
Molecules (Basel, Switzerland)
|
July 19, 2021
Measuring Shared Electrons in Extended Molecular Systems: Covalent Bonds from Plane-Wave Representation of Wave Function
Giovanni La Penna, Davide Tiana, Paolo Giannozzi
Chemical Science
|
January 3, 2017
Correction: A universal chemical potential for sulfur vapours
Adam J Jackson, Davide Tiana, Aron Walsh
Journal of Chemical Theory and Computation
|
January 10, 2015
Transferable Force Field for Metal-Organic Frameworks from First-Principles: BTW-FF
Jessica K Bristow, Davide Tiana, Aron Walsh
Physical Chemistry Chemical Physics : PCCP
|
August 4, 2012
Conductive metal-organic frameworks and networks: fact or fantasy?
Christopher H Hendon, Davide Tiana, Aron Walsh
Chemical Communications (Cambridge, England)
|
October 1, 2014
Ligand design for long-range magnetic order in metal-organic frameworks
Davide Tiana, Christopher H Hendon, Aron Walsh
Physical Chemistry Chemical Physics : PCCP
|
October 18, 2024
Computationally aided design of defect-appended aliphatic amines for CO<sub>2</sub> activation within UiO-66
Gerard Pareras, Albert Rimola, Marco Taddei, et al.
Dalton Transactions (Cambridge, England : 2003)
|
January 30, 2015
First principles static and dynamic calculations for the transition metal hydride series MH4L3 (M = Fe, Ru and Os; L = NH3, PH3 and PF3)
Nicolas Sieffert, Thomas Kendrick, Davide Tiana, et al.
Physical Chemistry Chemical Physics : PCCP
|
February 27, 2014
Computational screening of structural and compositional factors for electrically conductive coordination polymers
Davide Tiana, Christopher H Hendon, Aron Walsh, et al.
The Journal of Physical Chemistry. A
|
June 23, 2009
Using pseudopotentials within the interacting quantum atoms approach
Davide Tiana, E Francisco, M A Blanco, et al.
Page
of 3
Search research articles
Search
Showing results (1-10 of 30) with videos related to
Sort By:
Page
of 3
Chemical Science
|
June 14, 2018
A universal chemical potential for sulfur vapours
Adam J Jackson, Davide Tiana, Aron Walsh
Molecules (Basel, Switzerland)
|
July 19, 2021
Measuring Shared Electrons in Extended Molecular Systems: Covalent Bonds from Plane-Wave Representation of Wave Function
Giovanni La Penna, Davide Tiana, Paolo Giannozzi
Chemical Science
|
January 3, 2017
Correction: A universal chemical potential for sulfur vapours
Adam J Jackson, Davide Tiana, Aron Walsh
Journal of Chemical Theory and Computation
|
January 10, 2015
Transferable Force Field for Metal-Organic Frameworks from First-Principles: BTW-FF
Jessica K Bristow, Davide Tiana, Aron Walsh
Physical Chemistry Chemical Physics : PCCP
|
August 4, 2012
Conductive metal-organic frameworks and networks: fact or fantasy?
Christopher H Hendon, Davide Tiana, Aron Walsh
Chemical Communications (Cambridge, England)
|
October 1, 2014
Ligand design for long-range magnetic order in metal-organic frameworks
Davide Tiana, Christopher H Hendon, Aron Walsh
Physical Chemistry Chemical Physics : PCCP
|
October 18, 2024
Computationally aided design of defect-appended aliphatic amines for CO<sub>2</sub> activation within UiO-66
Gerard Pareras, Albert Rimola, Marco Taddei, et al.
Dalton Transactions (Cambridge, England : 2003)
|
January 30, 2015
First principles static and dynamic calculations for the transition metal hydride series MH4L3 (M = Fe, Ru and Os; L = NH3, PH3 and PF3)
Nicolas Sieffert, Thomas Kendrick, Davide Tiana, et al.
Physical Chemistry Chemical Physics : PCCP
|
February 27, 2014
Computational screening of structural and compositional factors for electrically conductive coordination polymers
Davide Tiana, Christopher H Hendon, Aron Walsh, et al.
The Journal of Physical Chemistry. A
|
June 23, 2009
Using pseudopotentials within the interacting quantum atoms approach
Davide Tiana, E Francisco, M A Blanco, et al.
Page
of 3