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The Journal of Chemical Physics
|
November 21, 2007
On the accuracy of density-functional theory exchange-correlation functionals for H bonds in small water clusters: benchmarks approaching the complete basis set limit
Biswajit Santra, Angelos Michaelides, Matthias Scheffler
The Journal of Chemical Physics
|
October 2, 2009
Coupled cluster benchmarks of water monomers and dimers extracted from density-functional theory liquid water: the importance of monomer deformations
Biswajit Santra, Angelos Michaelides, Matthias Scheffler
Physical Review Letters
|
August 8, 2009
Structural stability and magnetic and electronic properties of Co2MnSi(001)/MgO heterostructures: a density-functional theory study
Björn Hülsen, Matthias Scheffler, Peter Kratzer
European Journal of Cancer (Oxford, England : 1990)
|
October 31, 2024
Response to letter entitled: Re: Indirect comparison of capmatinib treatment from GEOMETRY mono-1 trial to SOC in German patients with locally advanced or metastatic NSCLC harboring METex14 skipping mutations
Anna Kron, Matthias Scheffler, Juergen Wolf
Journal of Thoracic Oncology : Official Publication of the International Association for the Study of Lung Cancer
|
October 25, 2023
In Response
Cristoph Arolt, Matthias Scheffler, Axel M Hillmer
Physical Review Letters
|
May 16, 2007
Towards an exact treatment of exchange and correlation in materials: application to the "CO adsorption puzzle" and other systems
Qing-Miao Hu, Karsten Reuter, Matthias Scheffler
Scientific Data
|
August 29, 2025
Materials Database from All-electron Hybrid Functional DFT Calculations
Akhil S Nair, Lucas Foppa, Matthias Scheffler
The Journal of Chemical Physics
|
October 17, 2015
Insight into organic reactions from the direct random phase approximation and its corrections
Adrienn Ruzsinszky, Igor Ying Zhang, Matthias Scheffler
Physical Review Letters
|
July 15, 2003
Why is a noble metal catalytically active? The role of the O-Ag interaction in the function of silver as an oxidation catalyst
Wei-Xue Li, Catherine Stampfl, Matthias Scheffler
Physical Review Letters
|
March 24, 2005
Preserving the half-metallicity at the Heusler alloy Co2MnSi(001) surface: a density functional theory study
S Javad Hashemifar, Peter Kratzer, Matthias Scheffler
Page
of 21
Search research articles
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Showing results (21-30 of 207) with videos related to
Sort By:
Page
of 21
The Journal of Chemical Physics
|
November 21, 2007
On the accuracy of density-functional theory exchange-correlation functionals for H bonds in small water clusters: benchmarks approaching the complete basis set limit
Biswajit Santra, Angelos Michaelides, Matthias Scheffler
The Journal of Chemical Physics
|
October 2, 2009
Coupled cluster benchmarks of water monomers and dimers extracted from density-functional theory liquid water: the importance of monomer deformations
Biswajit Santra, Angelos Michaelides, Matthias Scheffler
Physical Review Letters
|
August 8, 2009
Structural stability and magnetic and electronic properties of Co2MnSi(001)/MgO heterostructures: a density-functional theory study
Björn Hülsen, Matthias Scheffler, Peter Kratzer
European Journal of Cancer (Oxford, England : 1990)
|
October 31, 2024
Response to letter entitled: Re: Indirect comparison of capmatinib treatment from GEOMETRY mono-1 trial to SOC in German patients with locally advanced or metastatic NSCLC harboring METex14 skipping mutations
Anna Kron, Matthias Scheffler, Juergen Wolf
Journal of Thoracic Oncology : Official Publication of the International Association for the Study of Lung Cancer
|
October 25, 2023
In Response
Cristoph Arolt, Matthias Scheffler, Axel M Hillmer
Physical Review Letters
|
May 16, 2007
Towards an exact treatment of exchange and correlation in materials: application to the "CO adsorption puzzle" and other systems
Qing-Miao Hu, Karsten Reuter, Matthias Scheffler
Scientific Data
|
August 29, 2025
Materials Database from All-electron Hybrid Functional DFT Calculations
Akhil S Nair, Lucas Foppa, Matthias Scheffler
The Journal of Chemical Physics
|
October 17, 2015
Insight into organic reactions from the direct random phase approximation and its corrections
Adrienn Ruzsinszky, Igor Ying Zhang, Matthias Scheffler
Physical Review Letters
|
July 15, 2003
Why is a noble metal catalytically active? The role of the O-Ag interaction in the function of silver as an oxidation catalyst
Wei-Xue Li, Catherine Stampfl, Matthias Scheffler
Physical Review Letters
|
March 24, 2005
Preserving the half-metallicity at the Heusler alloy Co2MnSi(001) surface: a density functional theory study
S Javad Hashemifar, Peter Kratzer, Matthias Scheffler
Page
of 21