Adsorption of inert gases including element 118 on noble metal and inert surfaces from ab initio Dirac–Coulomb atomic calculations

2008 ◽  
Vol 129 (14) ◽  
pp. 144106 ◽  
Author(s):  
V. Pershina ◽  
A. Borschevsky ◽  
E. Eliav ◽  
U. Kaldor
Keyword(s):  
Ab Initio ◽  
Noble Metal ◽  
Inert Gases ◽  
Inert Surfaces

scholarly journals Low compressible noble metal carbides with rocksalt structure: Ab initio total energy calculations of the elastic stability

2006 ◽  
Vol 89 (7) ◽  
pp. 071913 ◽  
Author(s):  
Chang-Zeng Fan ◽  
Song-Yan Zeng ◽  
Zai-Ji Zhan ◽  
Ri-Ping Liu ◽  
Wen-Kui Wang ◽  
...  
Keyword(s):  
Total Energy ◽  
Ab Initio ◽  
Noble Metal ◽  
Elastic Stability ◽  
Metal Carbides ◽  
Energy Calculations ◽  
Rocksalt Structure

scholarly journals Unveiling the mechanism of high-performance hydrogen evolution reaction on noble-metal-free (113)-faceted Ni3C: ab initio calculations

RSC Advances ◽  
2022 ◽  
Vol 12 (2) ◽  
pp. 869-873
Author(s):  
Fuyun Hu ◽  
Jiahe Peng ◽  
Wei Xie ◽  
Neng Li
Keyword(s):  
Ab Initio Calculations ◽  
Ab Initio ◽  
Hydrogen Evolution ◽  
Noble Metal ◽  
Hydrogen Evolution Reaction ◽  
High Performance ◽  
Metal Free

High-performance hydrogen evolution reaction on noble-metal-free (113)-faceted Ni3C.

Physisorption mechanism in graphene/noble metal (111)/Ni(111) heterostructures: An ab-initio study

2016 ◽  
Vol 120 (7) ◽  
pp. 075301
Author(s):  
Mohammad Moaddeli ◽  
Hamdollah Salehi ◽  
Peiman Amiri
Keyword(s):  
Ab Initio ◽  
Noble Metal ◽  
Ab Initio Study

ChemInform Abstract: Rapid Microwave Preparation and ab initio Studies of the Stability of the Complex Noble Metal Oxides La2BaPdO5and La2BaPtO5.

ChemInform ◽  
2014 ◽  
Vol 45 (19) ◽  
pp. no-no
Author(s):  
Lauren M. Misch ◽  
Jakoah Brgoch ◽  
Alexander Birkel ◽  
Thomas E. Mates ◽  
Galen D. Stucky ◽  
...  
Keyword(s):  
Metal Oxides ◽  
Ab Initio ◽  
Noble Metal ◽  
Noble Metal Oxides ◽  
The Stability

An ab initio study of 5d noble metal nitrides: OsN2, IrN2, PtN2 and AuN2

2010 ◽  
Vol 150 (3-4) ◽  
pp. 181-186 ◽  
Author(s):  
W. Chen ◽  
J.S. Tse ◽  
J.Z. Jiang
Keyword(s):  
Ab Initio ◽  
Noble Metal ◽  
Metal Nitrides ◽  
Ab Initio Study
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