Miklos Kertesz: search on Z-Library

The world's largest scientific articles store. 70,000,000+ articles for free.

Don't use scam websites

1

Performance of the Vienna ab initio simulation package (VASP) in chemical applications

Guangyu Sun, Jenö Kürti, Péter Rajczy, Miklos Kertesz, Jürgen Hafner, Georg Kresse

Journal:

Journal of Molecular Structure: THEOCHEM

Year:

2003

Language:

english

File:

PDF, 181 KB

english, 2003

2

Interpolation of singular energy bands

Kertész, Miklós, Vonderviszt, Ferenc

Journal:

Physical Review B

Year:

1982

Language:

english

File:

PDF, 82 KB

english, 1982

3

Pancake bonding, an unusual pi-stacking interaction

Kertesz, Miklos

Journal:

Chemistry - A European Journal

Year:

2018

Language:

english

File:

PDF, 2.04 MB

english, 2018

4

Electronic structure of highly doped conducting polymers

Journal:

International Journal of Quantum Chemistry

Year:

1986

Language:

english

File:

PDF, 547 KB

english, 1986

5

Octahedral vs. trigonal-prismatic coordination and clustering in transition-metal dichalcogenides

Hoffmann, Roald, Kertesz, Miklos

Journal:

Journal of the American Chemical Society

Year:

1984

Language:

english

File:

PDF, 808 KB

english, 1984

6

Conjugated Polymers and Aromaticity

Kertesz, Miklos, Choi, Cheol Ho, Yang, Shujiang

Journal:

Chemical Reviews

Year:

2005

Language:

english

File:

PDF, 784 KB

english, 2005

7

Energy bands in solids: bonding, energy levels and orbitals

Kertesz, Miklos

Journal:

International Reviews in Physical Chemistry

Year:

1985

Language:

english

File:

PDF, 2.11 MB

english, 1985

8

Properties of Sizeable [ n ]Cycloparaphenylenes as Molecular Models of Single-Wall Carbon Nanotubes Elucidated by Raman Spectroscopy: Structural and Electron-Transfer Responses under Mechanical Stress

Alvarez, Miriam Peña, Burrezo, Paula Mayorga, Kertesz, Miklos, Iwamoto, Takahiro, Yamago, Shigeru, Xia, Jianlong, Jasti, Ramesh, Navarrete, Juan T. López, Taravillo, Mercedes, Baonza, Valentín G., Cas

Journal:

Angewandte Chemie International Edition

Year:

2014

Language:

english

File:

PDF, 586 KB

english, 2014

9

Simulations of large multi-atom vacancies in diamond

Laszlo, Istvan, Kertesz, Miklos, Slepetz, Brad, Gogotsi, Yury

Journal:

Diamond and Related Materials

Year:

2010

Language:

english

File:

PDF, 1.48 MB

english, 2010

10

Is There a Lower Limit to the CC Bonding Distances in Neutral Radical π-Dimers? The Case of Phenalenyl Derivatives

Tian, Yong-Hui, Kertesz, Miklos

Journal:

Journal of the American Chemical Society

Year:

2010

Language:

english

File:

PDF, 217 KB

english, 2010

11

Hypothetical metallic allotrope of carbon

Hoffmann, Roald, Hughbanks, Timothy, Kertesz, Miklos, Bird, Peter H.

Journal:

Journal of the American Chemical Society

Year:

1983

Language:

english

File:

PDF, 292 KB

english, 1983

12

Conformational Studies of Vibrational Properties and Electronic States of Leucoemeraldine Base and Its Oligomers

Choi, Cheol Ho, Kertesz, Miklos

Journal:

Year:

1997

Language:

english

File:

PDF, 209 KB

english, 1997

13

Application of a Novel Linear/Exponential Hybrid Force Field Scaling Scheme to the Longitudinal Raman Active Mode of Polyyne

Yang, Shujiang, Kertesz, Miklos, Zólyomi, Viktor, Kürti, Jenő

Journal:

Journal of Physical Chemistry A

Year:

2007

Language:

english

File:

PDF, 128 KB

english, 2007

14

Electronic structure and metallization of silicon

Biswas, Rana, Kertesz, Miklos

Journal:

Physical Review B

Year:

1984

Language:

english

File:

PDF, 462 KB

english, 1984

15

Different orbitals for different spins for solids: Fully variational ab initio studies on hydrogen and carbon atomic chains, polyene, and poly(sulphur nitride)

Kertész, Miklós, Koller, Jože, Ažman, Andrej

Journal:

Physical Review B

Year:

1979

Language:

english

File:

PDF, 437 KB

english, 1979

16

Ab initio numerical studies on density-matrix asymptotics in extended systems

Surján, Péter R., Kertész, Miklós, Karpfen, Alfred, Koller, Jože

Journal:

Physical Review B

Year:

1983

Language:

english

File:

PDF, 233 KB

english, 1983

17

Smooth energy-band interpolation with gradient utilization

Kertész, Miklós, Hughbanks, Timothy

Journal:

Physical Review B

Year:

1981

Language:

english

File:

PDF, 774 KB

english, 1981

18

Where concepts meet the real world: A systematic review of ecosystem service indicators and their classification using CICES

Czúcz, Bálint, Arany, Ildikó, Potschin-Young, Marion, Bereczki, Krisztina, Kertész, Miklós, Kiss, Márton, Aszalós, Réka, Haines-Young, Roy

Journal:

Ecosystem Services

Year:

2018

Language:

english

File:

PDF, 577 KB

english, 2018

19

Molecules Under Pressure: The Case of [n]Cycloparaphenylenes

Peña-Alvarez, Miriam, Qiu, Lili, Baonza, Valentín G., Taravillo, Mercedes, Kertesz, Miklos, Casado, Juan

Journal:

Chemistry of Materials

Year:

2018

Language:

english

File:

PDF, 2.73 MB

english, 2018

20

Enhancement of Ecological Field Experimental Research by Means of UAV Multispectral Sensing

Díaz-Delgado, Ricardo, Ónodi, Gábor, Kröel-Dulay, György, Kertész, Miklós

Journal:

Year:

2019

File:

PDF, 4.57 MB

2019

21

ChemInform Abstract: Theoretical Evidence for the Major Isomers of Fullerene C84 Based on 13C NMR Chemical Shifts.

Guangyu Sun, Miklos Kertesz

Journal:

Year:

2001

File:

PDF, 27 KB

2001

22

Conjugated Polymers and Aromaticity

Miklos Kertesz, Cheol Ho Choi, Shujiang Yang

Journal:

Year:

2006

File:

PDF, 8 KB

2006

23

Change of geometry of polyacetylene upon charge transfer

Miklós Kertész, Ferenc Vonderviszt, Sándor Pekker

Journal:

Chemical Physics Letters

Year:

1982

Language:

english

File:

PDF, 316 KB

english, 1982

24

The gradient of the total energy for metals

Journal:

Chemical Physics Letters

Year:

1984

Language:

english

File:

PDF, 243 KB

english, 1984

25

The graphite-to-diamond transformation

Miklos Kertesz, Roald Hoffmann

Journal:

Journal of Solid State Chemistry

Year:

1984

Language:

english

File:

PDF, 426 KB

english, 1984

26

Higher order Peierls distortion of one-dimensional carbon skeletons

Miklos Kertesz, Roald Hoffmann

Journal:

Solid State Communications

Year:

1983

Language:

english

File:

PDF, 246 KB

english, 1983

27

Resolution, accuracy and attributes: Approaches for environmental geographical information systems

Ferenc Csillag, Ágnes Kummert, Miklós Kertész

Journal:

Computers, Environment and Urban Systems

Year:

1992

Language:

english

File:

PDF, 609 KB

english, 1992

28

Intermolecular transfer integrals for organic molecular materials: can basis set convergence be achieved?

Jingsong Huang, Miklos Kertesz

Journal:

Chemical Physics Letters

Year:

2004

Language:

english

File:

PDF, 204 KB

english, 2004

29

Application of the linear/exponential hybrid force field scaling scheme to the bond length alternation modes of polyacetylene

Shujiang Yang, Miklos Kertesz

Journal:

Chemical Physics Letters

Year:

2006

Language:

english

File:

PDF, 189 KB

english, 2006

30

Confinement effects on site-preferences for cycloadditions into carbon nanotubes

Takashi Yumura, Miklos Kertesz, Sumio Iijima

Journal:

Chemical Physics Letters

Year:

2007

Language:

english

File:

PDF, 1.06 MB

english, 2007

31

Synthesis and enantiomeric recognition studies of dialkyl-substituted 18-crown-6 ethers containing an acridine fluorophore unit

Júlia Kertész, Ildikó Móczár, Attila Kormos, Péter Baranyai, Miklós Kubinyi, Klára Tóth, Péter Huszthy

Journal:

Tetrahedron: Asymmetry

Year:

2011

Language:

english

File:

PDF, 702 KB

english, 2011

32

Theoretical 13C NMR spectra of IPR isomers of fullerene C80: a density functional theory study

Guangyu Sun, Miklos Kertesz

Journal:

Chemical Physics Letters

Year:

2000

Language:

english

File:

PDF, 136 KB

english, 2000

33

A new partition of the atomic polar tensor: the benzene molecule

Cheol Ho Choi, Miklos Kertesz

Journal:

Chemical Physics Letters

Year:

1996

Language:

english

File:

PDF, 375 KB

english, 1996

34

Limitations of current density functional theories for the description of partial π-bond breaking

Cheol Ho Choi, Miklos Kertesz, Alfred Karpfen

Journal:

Chemical Physics Letters

Year:

1997

Language:

english

File:

PDF, 219 KB

english, 1997

35

Is a 1.90 Å C–C bond length in polymeric fullerides possible?

Cheol Ho Choi, Miklos Kertesz

Journal:

Chemical Physics Letters

Year:

1998

Language:

english

File:

PDF, 170 KB

english, 1998

36

Need for electronic correlation calculations in polymers

Miklos Kertesz, Joze Koller, Andrej Azman

Journal:

International Journal of Quantum Chemistry

Year:

1980

Language:

english

File:

PDF, 226 KB

english, 1980

37

The effect of additional fused rings on the stabilities and the band gaps of heteroconjugated polymers

Yong S. Lee, Miklos Kertesz

Journal:

International Journal of Quantum Chemistry

Year:

1987

Language:

english

File:

PDF, 367 KB

english, 1987

38

Structure and electronic structure of polyacene

Miklos Kertesz, Yong S. Lee, James J. P. Stewart

Journal:

International Journal of Quantum Chemistry

Year:

1989

Language:

english

File:

PDF, 487 KB

english, 1989

39

Eine neue Methode zur Berechnung der Ladungsverteilung in Polymeren unter Berücksichtigung der Endeffekte

Géza Biczó, Miklós Kertész, Sándor Suhai

Journal:

Zeitschrift für Chemie

Year:

1975

Language:

german

File:

PDF, 257 KB

german, 1975

40

Ab initiocrystal orbital studies on linear chains of H atoms

Miklos Kertesz, Jože Koller, Andrej Ažman

Journal:

Theoretical Chemistry Accounts: Theory, Computation, and Modeling (Theoretica Chimica Acta)

Year:

1976

Language:

english

File:

PDF, 121 KB

english, 1976

41

Statistical and biological consequences of preferential sampling in phytosociology: Theoretical considerations and a case study

Zoltán Botta-Dukát, Edit Kovács-Láng, Tamás Rédei, Miklós Kertész, János Garadnai

Journal:

Folia Geobotanica

Year:

2007

Language:

english

File:

PDF, 778 KB

english, 2007

42

Argon-matrix-isolation Raman spectra and density functional study of 1,3-butadiene conformers

Cheol Ho Choi, Miklos Kertesz, Sergey Dobrin, Josef Michl

Journal:

Theoretical Chemistry Accounts: Theory, Computation, and Modeling (Theoretica Chimica Acta)

Year:

1999

Language:

english

File:

PDF, 204 KB

english, 1999

43

Rare primary extranodal lymphomas: diffuse large B-cell lymphomas of the genital tract

Péter Rajnics, Judit Demeter, Judit Csomor, László Krenács, László Pajor, Balázs Kollár, Zsuzsanna Kertész, Miklós Egyed

Journal:

Annals of Hematology

Year:

2009

Language:

english

File:

PDF, 125 KB

english, 2009

44

Resource transport between ramets alters soil resource pattern: a simulation study on clonal growth

Gabriella Magyar, Miklós Kertész, Beáta Oborny

Journal:

Evolutionary Ecology

Year:

2004

Language:

english

File:

PDF, 536 KB

english, 2004

45

Helical Peierls distortion: Formation of helices of polyketone and polyisocyanide

Chang-Xing Cui, Miklos Kertesz

Journal:

Chemical Physics Letters

Year:

1990

Language:

english

File:

PDF, 384 KB

english, 1990

46

13C NMR spectra for IPR isomers of fullerene C86

Guangyu Sun, Miklos Kertesz

Journal:

Chemical Physics

Year:

2002

Language:

english

File:

PDF, 115 KB

english, 2002

47

Comparison of the AMPA Antagonist Action of New 2,3-Benzodiazepinesin Vitroand Their Neuroprotective Effectsin Vivo

Gábor Kapus, Szabolcs Kertész, Gábor Gigler, Annamária Simó, Miklos Vegh, József Barkóczy, László G. Hársing, Géza Szabó, György Lévay

Journal:

Pharmaceutical Research

Year:

2004

Language:

english

File:

PDF, 112 KB

english, 2004

48

Cooperative Behaviors in Carbene Additions through Local Modifications of Nanotube Surfaces

Yumura, Takashi, Kertesz, Miklos

Journal:

Chemistry of Materials

Year:

2007

Language:

english

File:

PDF, 389 KB

english, 2007

49

Local Modifications of Single-Wall Carbon Nanotubes Induced by Bond Formation with Encapsulated Fullerenes

Yumura, Takashi, Kertesz, Miklos, Iijima, Sumio

Journal:

Journal of Physical Chemistry B

Year:

2007

Language:

english

File:

PDF, 1.30 MB

english, 2007

50

Inorganic rings, intact and cleaved, between two metal fragments

Kertesz, Miklos, Tremel, Wolfgang, Hoffmann, Roald

Journal:

Journal of the American Chemical Society

Year:

1989

Language:

english

File:

PDF, 1.07 MB

english, 1989