Ionization Potentials of Tantalum−Carbide Clusters:  An Experimental and Density Functional Theory Study

Viktoras Dryza; M. A. Addicoat; Jason R. Gascooke; Mark A. Buntine; Gregory F. Metha

doi:10.1021/jp054410r

Ionization Potentials of Tantalum−Carbide Clusters: An Experimental and Density Functional Theory Study

The Journal of Physical Chemistry A ◽

10.1021/jp054410r ◽

2005 ◽

Vol 109 (49) ◽

pp. 11180-11190 ◽

Cited By ~ 15

Author(s):

Viktoras Dryza ◽

M. A. Addicoat ◽

Jason R. Gascooke ◽

Mark A. Buntine ◽

Gregory F. Metha

Keyword(s):

Density Functional Theory ◽

Density Functional ◽

Tantalum Carbide ◽

Ionization Potentials ◽

Density Functional Theory Study ◽

Functional Theory

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The density functional theory study on the ionization potentials and electron affinities of cytosine-formamide complexes

Russian Journal of Physical Chemistry A ◽

10.1134/s0036024409030200 ◽

2009 ◽

Vol 83 (3) ◽

pp. 436-443

Author(s):

Chun-fang Su ◽

Yan-min Li ◽

Zheng-yu Zhou ◽

Xiang-xiang Wang ◽

Ke-sheng Ma

Keyword(s):

Density Functional Theory ◽

Density Functional ◽

Ionization Potentials ◽

Electron Affinities ◽

Density Functional Theory Study ◽

Functional Theory ◽

The Density Functional Theory

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Neutral Tantalum−Carbide Clusters: A Multiphoton Ionization and Density Functional Theory Study

The Journal of Physical Chemistry A ◽

10.1021/jp993489v ◽

2000 ◽

Vol 104 (15) ◽

pp. 3308-3316 ◽

Cited By ~ 25

Author(s):

Michael W. Heaven ◽

Gerarda M. Stewart ◽

Mark A. Buntine ◽

Gregory F. Metha

Keyword(s):

Density Functional Theory ◽

Density Functional ◽

Multiphoton Ionization ◽

Tantalum Carbide ◽

Density Functional Theory Study ◽

Functional Theory

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Density functional theory study on the ionization potentials and electron affinities of thymine-formamide complexes

International Journal of Quantum Chemistry ◽

10.1002/qua.21951 ◽

2009 ◽

Vol 109 (6) ◽

pp. 1410-1417 ◽

Cited By ~ 1

Author(s):

Haitao Sun ◽

Ke Tang ◽

Yanmin Li ◽

Chunfang Su ◽

Zhengyu Zhou ◽

...

Keyword(s):

Density Functional Theory ◽

Density Functional ◽

Ionization Potentials ◽

Electron Affinities ◽

Density Functional Theory Study ◽

Functional Theory

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Methylene imino radical H2CN : matrix isolation ESR and density functional theory study

Molecular Physics ◽

10.1080/002689799165107 ◽

1999 ◽

Vol 96 (6) ◽

pp. 993-1000 ◽

Cited By ~ 2

Author(s):

PAUL H. KASAI

Keyword(s):

Density Functional Theory ◽

Density Functional ◽

Matrix Isolation ◽

Density Functional Theory Study ◽

Functional Theory

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A Density Functional Theory Study of 2-Chlorothiophene Adsorption on Rh(111) Surface

CHINESE JOURNAL OF CATALYSIS (CHINESE VERSION) ◽

10.3724/sp.j.1088.2010.90513 ◽

2010 ◽

Vol 31 (1) ◽

pp. 49-55

Author(s):

Zhanhong CHEN ◽

Kaining DING ◽

Xianglan XU ◽

Junqian LI

Keyword(s):

Density Functional Theory ◽

Density Functional ◽

Density Functional Theory Study ◽

Functional Theory

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Density Functional Theory Study on the Relationship between Polymerization Activity and Substituent Electronic Effect of Polyolefin Catalysts

CHINESE JOURNAL OF CATALYSIS (CHINESE VERSION) ◽

10.3724/sp.j.1088.2010.00126 ◽

2010 ◽

Vol 31 (9) ◽

pp. 1127-1131

Author(s):

Huayi LI ◽

Liaoyun ZHANG ◽

Youliang HU

Keyword(s):

Density Functional Theory ◽

Density Functional ◽

Electronic Effect ◽

Density Functional Theory Study ◽

Functional Theory ◽

The Relationship

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Density Functional Theory Study of the Gas Phase and Surface Reaction Kinetics for the MOVPE Growth of GaAs1–yBiy

The Journal of Physical Chemistry A ◽

10.1021/acs.jpca.9b10399 ◽

2020 ◽

Vol 124 (9) ◽

pp. 1682-1697

Author(s):

Ryan C. Lucas ◽

Dane Morgan ◽

Thomas F. Kuech

Keyword(s):

Density Functional Theory ◽

Reaction Kinetics ◽

Gas Phase ◽

Density Functional ◽

Surface Reaction ◽

Density Functional Theory Study ◽

Functional Theory ◽

Movpe Growth ◽

Surface Reaction Kinetics

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Structural Stability of Ruthenium Nanoparticles: A Density Functional Theory Study

The Journal of Physical Chemistry C ◽

10.1021/acs.jpcc.7b08672 ◽

2017 ◽

Vol 121 (49) ◽

pp. 27445-27452 ◽

Cited By ~ 21

Author(s):

Yusuke Nanba ◽

Takayoshi Ishimoto ◽

Michihisa Koyama

Keyword(s):

Density Functional Theory ◽

Structural Stability ◽

Density Functional ◽

Density Functional Theory Study ◽

Ruthenium Nanoparticles ◽

Functional Theory

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Density Functional Theory Study on Electronic and Magnetic Properties of Mn‐Doped (MgO)n (n=2–10) Clusters

Chinese Journal of Chemical Physics ◽

10.1063/1674-0068/26/01/35-42 ◽

2013 ◽

Vol 26 (1) ◽

pp. 35-42 ◽

Cited By ~ 10

Author(s):

Peng Wang ◽

Ming‐xia Yang ◽

Sheng‐li Zhang ◽

Shi‐ping Huang ◽

Hui‐ping Tian

Keyword(s):

Density Functional Theory ◽

Magnetic Properties ◽

Density Functional ◽

Density Functional Theory Study ◽

Functional Theory ◽

Electronic And Magnetic Properties ◽

Mn Doped

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Nitrotyrosine adsorption on carbon nanotube: a density functional theory study

Indian Journal of Physics ◽

10.1007/s12648-013-0438-6 ◽

2014 ◽

Vol 88 (5) ◽

pp. 483-487 ◽

Cited By ~ 15

Author(s):

R. Majidi ◽

A. R. Karami

Keyword(s):

Density Functional Theory ◽

Carbon Nanotube ◽

Density Functional ◽

Density Functional Theory Study ◽

Functional Theory

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