J. Häfner - Publications, H-index & Citations

J. Häfner

institute of physics, sas

72H指数

552论文数

10.0W被引数

收录论文 97

发表时间

Understanding the selectivity of methanol steam reforming on the (111) surfaces of NiZn, PdZn and PtZn: Insights from DFT

JOURNAL OF CATALYSIS

IF6.5

2015-10-01

PREAI

Krajci, M.; Tsai, A. -P.; Hafner, J.

Semihydrogenation of Acetylene on the (010) Surface of GaPd2: Ga Enrichment Improves Selectivity

JOURNAL OF PHYSICAL CHEMISTRY C

IF3.2

2014-05-29

PREAI

Krajci, M.; Hafner, J.

Selective semi-hydrogenation of acetylene: Atomistic scenario for reactions on the polar threefold surfaces of GaPd

JOURNAL OF CATALYSIS

IF6.5

2014-04-01

PREAI

Krajci, M.; Hafner, J.

Structure and chemical reactivity of the polar three-fold surfaces of GaPd: A density-functional study

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2013-03-26

PREAI

Krajci, M.; Hafner, J.

Surfaces of intermetallic compounds: An ab initio DFT study for B20-type AlPd

PHYSICAL REVIEW B

IF3.7

2013-01-30

PREAI

Krajci, M.; Hafner, J.

The (210) surface of intermetallic B20 compound GaPd as a selective hydrogenation catalyst: A DFT study

JOURNAL OF CATALYSIS

IF6.5

2012-11-01

PREAI

Krajci, M.; Hafner, J.

Intermetallic Compound AlPd As a Selective Hydrogenation Catalyst: A DFT Study

JOURNAL OF PHYSICAL CHEMISTRY C

IF3.2

2012-03-06

PREAI

Krajci, M.; Hafner, J.

Surface structures of complex intermetallic compounds: An ab initio DFT study for the (100) surface of o-Al13Co4

PHYSICAL REVIEW B

IF3.7

2011-09-12

PREAI

Krajci, M.; Hafner, J.

Dehydrogenation of propane over Zn-MOR. Static and dynamic reaction energy diagram

JOURNAL OF CATALYSIS

IF6.5

2011-01-03

PREAI

Benco, L.; Bucko, T.; Hafner, J.

Structure of the (010) surface of the orthorhombic complex metallic alloy T-Al3(Mn,Pd)

PHYSICAL REVIEW B

IF3.7

2010-03-17

OAAI

Deniozou, Th.; Addou, R.; Shukla, A. K.; Heggen, M.; Feuerbacher, M.; Krajci, M.; Hafner, J.; Widmer, R.; Groening, O.; Fournee, V.; Dubois, J. -M.; Ledieu, J.

Magnetism at surfaces and defects in icosahedral Al-Pd-Mn quasicrystals

PHYSICAL REVIEW B

IF3.7

2009-12-21

PREAI

Krajci, M.; Hafner, J.

Quasiperiodic layers of free-electron metals studied using electron diffraction

PHYSICAL REVIEW B

IF3.7

2009-04-29

OAAI

Shukla, A. K.; Dhaka, R. S.; D'Souza, S. W.; Singh, Sanjay; Wu, D.; Lograsso, T. A.; Krajci, M.; Hafner, J.; Horn, K.; Barman, S. R.

Nucleation of Pb starfish clusters on the five-fold Al-Pd-Mn quasicrystal surface

PHYSICAL REVIEW B

IF3.7

2009-04-23

OAAI

Ledieu, J.; Krajci, M.; Hafner, J.; Leung, L.; Wearing, L. H.; McGrath, R.; Lograsso, T. A.; Wu, D.; Fournee, V.

Magnetism and chemical ordering in icosahedral Al-Pd-Mn quasicrystal

PHYSICAL REVIEW B

IF3.7

2008-12-30

PREAI

Krajci, M.; Hafner, J.

Crystal structure prediction of LiBeH3 using ab initio total-energy calculations and evolutionary simulations

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2008-12-18

PREAI

Hu, Chao-Hao; Oganov, A. R.; Wang, Y. M.; Zhou, H. Y.; Lyakhov, A.; Hafner, J.

Adsorption of NO on Pd-exchanged mordenite: Ab initio DFT modeling

JOURNAL OF PHYSICAL CHEMISTRY C

IF3.2

2008-07-23

PREAI

Grybos, R.; Hafner, J.; Benco, L.; Raybaud, P.

Fivefold i-Al-Pd-Mn surface as template for growing monatomic quasiperiodic layers:: First-principles simulations for adatoms from groups one to three

PHYSICAL REVIEW B

IF3.7

2008-04-07

PREAI

Krajci, Marian; Hafner, J.

Density functional study of structures and mechanical properties of Y-doped α-SiAlONs

JOURNAL OF THE EUROPEAN CERAMIC SOCIETY

IF6.2

2008-01-01

PREAI

Benco, L.; Hafner, J.; Lences, Z.; Sajgalik, P.

Proton exchange of small hydrocarbons over acidic chabazite:: Ab initio study of entropic effects

JOURNAL OF CATALYSIS

IF6.5

2007-08-15

PREAI

Bucko, Tomas; Benco, Lubomir; Hafner, Juergen; Angyan, Janos G.

Pseudomorphic quasiperiodic alkali metal monolayers on an i-Al-Pd-Mn surface

PHYSICAL REVIEW B

IF3.7

2007-06-14

PREAI

Krajci, M.; Hafner, J.

研究方向