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2017
1 Chen, De; Mahmoodinia, Mehdi; Astrand, Per Olof.
Frontiers in carbon nanomaterials for energy conversion: from 0 to 3 dimensions. Carbon research frontiers, 2017; 2017-06-22
NTNU Untitled
 
2 Mahmoodinia, Mehdi; Åstrand, Per-Olof; Chen, De.
Tuning the Electronic Properties of Single-Atom Pt Catalysts by Functionalization of the Carbon Support Material. Journal of Physical Chemistry C 2017 ;Volum 121. s. 20802-20812
NTNU Untitled
 
2016
3 Mahmoodinia, Mehdi; Chen, De; Åstrand, Per-Olof.
Platinum clusters with a carbon support material as catalysts: ReaxFF simulations and DFT calculations. Magical Mystery Tour of Electron Correlation; 2016-10-24 - 2016-10-26
NTNU Untitled
 
4 Mahmoodinia, Mehdi; Trinh, Thuat; Åstrand, Per-Olof.
Bond Scission Mechanisms of Ethylene Glycol on Pt Catalyst: Density Functional Theory. The 8th Molecular Quantum Mechanics; 2016-06-26 - 2016-07-01
NTNU Untitled
 
5 Mahmoodinia, Mehdi; Åstrand, Per-Olof; Chen, De.
CO Activation on Edge Functionalized Graphene-based Pt Clusters: Electronic and Catalytic Properties. Girona Seminar 2016: “Predictive Catalysis: Transition-Metal Reactivity by Design”; 2016-04-17 - 2016-04-20
NTNU Untitled
 
6 Mahmoodinia, Mehdi; Åstrand, Per-Olof; Chen, De.
Influence of Carbon Support on Electronic Structure and Catalytic Activity of Pt Catalysts: Binding to the CO Molecule. Journal of Physical Chemistry C 2016 ;Volum 120. s. 12452-12462
NTNU Untitled
 
7 Åstrand, Per-Olof; Mahmoodinia, Mehdi; Chen, De.
Metal clusters on carbon surfaces as catalysts: Molecular dynamics simulations and quantum chemical calculations. International Conference of Computational Methods in Sciences and Engineering; 2016-03-17 - 2016-03-20
NTNU Untitled
 
2015
8 Mahmoodinia, Mehdi; Ebadi, Mahsa; Åstrand, Per-Olof; Chen, De.
Atomic and electronic structure of transition metal-graphene nanoflake interactions. The 15th International Congress of Quantum Chemistry; 2015-06-08 - 2015-06-13
NTNU Untitled
 
9 Mahmoodinia, Mehdi; Åstrand, Per-Olof; Chen, De.
Chemical Bonding and Electronic Properties of the Co Adatom and Dimer Interacting with Polyaromatic Hydrocarbons. Journal of Physical Chemistry C 2015 ;Volum 119.(43) s. 24425-24438
NTNU Untitled
 
10 Mahmoodinia, Mehdi; Åstrand, Per-Olof; Chen, De.
Density Functional Study of CO Adsorption on Edge-Functionalized Graphene-Supported Pt Clusters. Annual Meeting in Quantum and Computational Chemistry; 2015-06-29 - 2015-06-30
NTNU Untitled
 
11 Mahmoodinia, Mehdi; Åstrand, Per-Olof; Chen, De.
Reactivity of metal atoms and clusters on carbon surfaces: Insights from Reax simulations and DFT calculations. Pacifichem; 2015-12-15 - 2015-12-20
NTNU Untitled
 
2014
12 Mahmoodinia, Mehdi; Ebadi, Mahsa; Åstrand, Per-Olof; Chen, De; Cheng, Hong-ye; Zhu, Yi-An.
Structural and electronic properties of the Ptn–PAH complex (n = 1, 2) from density functional calculations. Physical Chemistry, Chemical Physics - PCCP 2014 ;Volum 16.(34) s. 18586-18595
NTNU Untitled
 
2013
13 Mahmoodinia, Mehdi; Åstrand, Per-Olof; Chen, De.
Adsorption of the platinum dimer on polyaromatic hydrocarbons by density functional theory calculations. Very Accurate and Large Computations and Applications 2013; 2013-06-09 - 2013-06-12
NTNU Untitled