Itai Panas: search on Z-Library

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1

Model studies of the chemisorption of hydrogen and oxygen on Cu(100)

Mattsson, Anders, Panas, Itai, Siegbahn, Per, Wahlgren, Ulf, Akeby, Hans

Journal:

Physical Review B

Year:

1987

Language:

english

File:

PDF, 600 KB

english, 1987

2

Role of potassium in the enhancement of the catalytic activity of calcium oxide towards tar reduction

Knutsson, Pavleta, Cantatore, Valentina, Seemann, Martin, Tam, Pui Lam, Panas, Itai

Journal:

Applied Catalysis B: Environmental

Year:

2018

Language:

english

File:

PDF, 2.92 MB

english, 2018

3

Aspects of density functional theory in ab initio quantum chemistry: external correlation for free

Journal:

Chemical Physics Letters

Year:

1995

Language:

english

File:

PDF, 461 KB

english, 1995

4

Superatom representation of high-TC superconductivity

Journal:

Physica C: Superconductivity

Year:

2012

Language:

english

File:

PDF, 738 KB

english, 2012

5

Early hydration and setting of Portland cement monitored by IR, SEM and Vicat techniques

Rikard Ylmén, Ulf Jäglid, Britt-Marie Steenari, Itai Panas

Journal:

Cement and Concrete Research

Year:

2009

Language:

english

File:

PDF, 604 KB

english, 2009

6

Design strategy of a graphene based bio-sensor for glucose

Cantatore, Valentina, Pandit, Santosh, Mokkapati, V.R.S.S., Schindler, Severin, Eigler, Siegfried, Mijakovic, Ivan, Panas, Itai

Journal:

Year:

2018

Language:

english

File:

PDF, 1.38 MB

english, 2018

7

Transition metal complexes with (NO)3− anions

Itai Panas, Anders Snis, Filip Acke, Tobias Johnson

Journal:

Chemical Physics Letters

Year:

1999

Language:

english

File:

PDF, 189 KB

english, 1999

8

Ab initio investigation of methyl adsorption on Ni(111)

Josef Schüle, Itai Panas, Per Siegbahn, Ulf Wahlgren

Journal:

Journal of Molecular Structure: THEOCHEM

Year:

1988

Language:

english

File:

PDF, 211 KB

english, 1988

9

Hydrolysis on Transition Metal Oxide Clusters and the Stabilities of M−O−M Bridges

Johnson, J. R. Tobias, Panas, Itai

Journal:

Inorganic Chemistry

Year:

2000

Language:

english

File:

PDF, 298 KB

english, 2000

10

Limiting properties of (MgO)n and (CaO)n clusters

Bawa, Fathi, Panas, Itai

Journal:

Physical Chemistry Chemical Physics

Year:

2001

Language:

english

File:

PDF, 176 KB

english, 2001

11

on BaO(001)

Grönbeck, Henrik, Panas, Itai

Journal:

Physical Review B

Year:

2008

Language:

english

File:

PDF, 579 KB

english, 2008

12

Possible origin and roles of nano-porosity in ZrO 2 scales for hydrogen pick-up in Zr alloys

Lindgren, Mikaela, Geers, Christine, Panas, Itai

Journal:

Journal of Nuclear Materials

Year:

2017

Language:

english

File:

PDF, 4.56 MB

english, 2017

13

Chemical state and atomic scale environment of nickel in the corrosion layer of irradiated Zircaloy-2 at a burn-up around 45 MWd/kg

Kuri, Goutam, Ramanantoanina, Harry, Bertsch, Johannes, Martin, Matthias, Panas, Itai

Journal:

Corrosion Science

Year:

2018

Language:

english

File:

PDF, 937 KB

english, 2018

14

Chromic acid evaporation upon exposure of Cr2O3(s) to H2O(g) and O2(g) – mechanism from first principles

Itai Panas, Jan-Erik Svensson, Henrik Asteman, Tobias J.R. Johnson, Lars-Gunnar Johansson

Journal:

Chemical Physics Letters

Year:

2004

Language:

english

File:

PDF, 427 KB

english, 2004

15

In situ IR study on the initial sulphition and carbonation of Ca(OH)2 and CaO by SO2 polluted air

Pernilla Elfving, Itai Panas, Oliver Lindqvist

Journal:

Atmospheric Environment

Year:

1996

Language:

english

File:

PDF, 499 KB

english, 1996

16

Electronic and geometric structure of the copper (Cun) cluster anions (n .ltoreq. 10)

Aakeby, Hans., Panas, Itai., Pettersson, Lars G. M., Siegbahn, Per., Wahlgren, Ulf.

Journal:

Journal of Physical Chemistry

Year:

1990

Language:

english

File:

PDF, 938 KB

english, 1990

17

Insights into the zinc effect on radio-cobalt deposition on stainless steel piping surfaces under BWR conditions from experiment guided 1st principles modelling

Cantatore, Valentina, Geers, Christine, Chen, Jiaxin, Panas, Itai

Journal:

Journal of Nuclear Materials

Year:

2020

File:

PDF, 1.46 MB

2020

18

Effective dynamic correlation in multiconfigurational wave-function calculations on atoms and molecules

Itai Panas, Anders Snis

Journal:

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

Year:

1997

Language:

english

File:

PDF, 398 KB

english, 1997

19

Paralinear Oxidation of Chromium in O2+ H2O Environment at 600–700

Bagas Pujilaksono, Torbjörn Jonsson, Mats Halvarsson, Itai Panas, Jan-Erik Svensson, Lars-Gunnar Johansson

Journal:

Oxidation of Metals

Year:

2008

Language:

english

File:

PDF, 1.13 MB

english, 2008

20

Quantum Chemical Modeling of the Reduction of Quinones

Johnsson Wass, J. R. Tobias, Ahlberg, Elisabet, Panas, Itai, Schiffrin, David J.

Journal:

Journal of Physical Chemistry A

Year:

2006

Language:

english

File:

PDF, 345 KB

english, 2006

21

Abstraction of preadsorbed oxygen from CaO(100) by carbon monoxide

Anders Snis, Itai Panas, Dan Strömberg

Journal:

Surface Science

Year:

1994

Language:

english

File:

PDF, 266 KB

english, 1994

22

Effects of O 2 on the Reduction of NO over Prereduced CaO Surfaces: A Mechanistic Understanding

Acke, Filip, Panas, Itai

Journal:

Journal of Physical Chemistry B

Year:

1999

Language:

english

File:

PDF, 111 KB

english, 1999

23

Quantum Chemical Formulation of High- T C Superconductivity

Journal:

Journal of Physical Chemistry B

Year:

1999

Language:

english

File:

PDF, 137 KB

english, 1999

24

Quantum chemical modelling of the rate determining step for oxygen reduction on quinones

Wass, J. R. Tobias Johnsson, Ahlberg, Elisabet, Panas, Itai, Schiffrin, David J.

Journal:

Physical Chemistry Chemical Physics

Year:

2006

Language:

english

File:

PDF, 857 KB

english, 2006

25

Possible electronic properties in high-Tc superconducting cuprates from cluster calculations

Itai Panas, Refael Gatt

Journal:

Chemical Physics Letters

Year:

1996

Language:

english

File:

PDF, 368 KB

english, 1996

26

Water Adsorption and Hydrolysis on Molecular Transition Metal Oxides and Oxyhydroxides

Johnson, J. R. Tobias, Panas, Itai

Journal:

Inorganic Chemistry

Year:

2000

Language:

english

File:

PDF, 216 KB

english, 2000

27

Structures and stabilities of some neutral and anionic (NO)n Hm based compounds (n= 2-8, m= 0-2)

SNIS, ANDERS, PANAS, ITAI

Journal:

Molecular Physics

Year:

1997

Language:

english

File:

PDF, 362 KB

english, 1997

28

Spectroscopic Properties of the High-T c Materials by the Ab Initio Quantum Chemistry Paradigm

Panas, Itai, Johnson, Tobias, Snis, Anders

Journal:

International Journal of Modern Physics B

Year:

1998

Language:

english

File:

PDF, 357 KB

english, 1998

29

Possible socket-plug standard connection for functionalized graphene – Validation by DFT

Cantatore, Valentina, Panas, Itai

Journal:

Year:

2016

Language:

english

File:

PDF, 1.73 MB

english, 2016

30

Communication: Towards catalytic nitric oxide reduction via oligomerization on boron doped graphene

Cantatore, Valentina, Panas, Itai

Journal:

The Journal of Chemical Physics

Year:

2016

Language:

english

File:

PDF, 1.56 MB

english, 2016

31

Evidence for Electron Transfer between Graphene and Non- covalently Bound Ï-Systems

BrÃ¼lls, Steffen, Cantatore, Valentina, Wang, Zhenping, Tam, Pui Lam, Malmberg, Per, Stubbe, Jessica, Sarkar, Biprajit, Panas, Itai, MÃ¥rtensson, Jerker, Eigler, Siegfried

Journal:

Chemistry - A European Journal

Year:

2020

Language:

english

File:

PDF, 5.16 MB

english, 2020

32

Pauli repulsion and dispersion interaction in the self-consistent crystal field concept applied to the structures of solid HCN

Journal:

Chemical Physics Letters

Year:

1993

Language:

english

File:

PDF, 489 KB

english, 1993

33

NOx storage on BaO: theory and experiment

Peter Broqvist, Henrik Grönbeck, Erik Fridell, Itai Panas

Journal:

Catalysis Today

Year:

2004

Language:

english

File:

PDF, 305 KB

english, 2004

34

On the superconductivity in (Sr, Ca)14Cu24O41 — towards a chemical standard model

Itai Panas, Refael Gatt

Journal:

Chemical Physics Letters

Year:

1997

Language:

english

File:

PDF, 282 KB

english, 1997

35

Antagonistic effect of superplasticizer and colloidal nano-silica in the hydration of Alite and Belite pastes

Joakim Björnström, Itai Panas

Journal:

Journal of Materials Science

Year:

2007

Language:

english

File:

PDF, 288 KB

english, 2007

36

Toward a Realistic Description of NO x Storage in BaO: The Aspect of BaCO 3

Broqvist, Peter, Panas, Itai, Grönbeck, Henrik

Journal:

Journal of Physical Chemistry B

Year:

2005

Language:

english

File:

PDF, 394 KB

english, 2005

37

A Coulomb hole approach to the binding in Cr2

Journal:

Molecular Physics

Year:

1996

Language:

english

File:

PDF, 208 KB

english, 1996

38

AIP Conference Proceedings [AIP High temperature superconductivity - Coral Gables, Florida (USA) (7-13 Jan 1999)] - Microscopic theory for high-T[sub c] superconductivity

Year:

1999

Language:

english

File:

PDF, 255 KB

english, 1999

39

Reactive Element Effects in High-Temperature Alloys Disentangled

Babic, Vedad, Geers, Christine, Panas, Itai

Journal:

Oxidation of Metals

Year:

2019

File:

PDF, 1.58 MB

2019

40

N2O adsorption and decomposition at a CaO(100) surface, studied by means of theory

Anders Snis, Dan Strömberg, Itai Panas

Journal:

Surface Science Letters

Year:

1993

Language:

english

File:

PDF, 72 KB

english, 1993

41

Surface complexes of nitric oxide:: adsorption of anionic NO and N2O2 on CaO

Anders Snis, Itai Panas

Journal:

Surface Science

Year:

1998

Language:

english

File:

PDF, 303 KB

english, 1998

42

A Mechanistic Investigation of Ethylene Oxide Hydrolysis to Ethanediol

Lundin, Angelica, Panas, Itai, Ahlberg, Elisabet

Journal:

Journal of Physical Chemistry A

Year:

2007

Language:

english

File:

PDF, 362 KB

english, 2007

43

Possible influences of ionic charges, radii, softness and magnetic impurities on the superconductivity in cuprates

Itai Panas, Refael Gatt

Journal:

Chemical Physics Letters

Year:

1996

Language:

english

File:

PDF, 304 KB

english, 1996

44

A self-consistent crystal field approach to the structures of molecular crystals applied to solid HCN

Journal:

Chemical Physics Letters

Year:

1992

Language:

english

File:

PDF, 406 KB

english, 1992

45

Model study of the first steps in the deterioration of calcareous stone I. Initial surface sulphite formation on calcite

Pernilla Elfving, Itai Panas, Oliver Lindqvist

Journal:

Applied Surface Science

Year:

1994

Language:

english

File:

PDF, 655 KB

english, 1994

46

Towards multifunctional coating in the boron-doped graphene/copper system

Cantatore, Valentina, Panas, Itai

Journal:

Year:

2017

Language:

english

File:

PDF, 1.16 MB

english, 2017

47

Switching on the Electrocatalytic Ethene Epoxidation on Nanocrystalline RuO 2

Jirkovský, Jakub S., Busch, Michael, Ahlberg, Elisabet, Panas, Itai, Krtil, Petr

Journal:

Journal of the American Chemical Society

Year:

2011

Language:

english

File:

PDF, 4.39 MB

english, 2011

48

HIGH-Tc SC AND CMR MADE CHEMICALLY INTUITIVE

Itai Panas, Refael Gatt, Tobias Johnson

Journal:

Journal of Physics and Chemistry of Solids

Year:

1998

Language:

english

File:

PDF, 373 KB

english, 1998

49

Model studies of the chemisorption of hydrogen and oxygen on nickel surfaces

Itai Panas, Per Siegbahn, Ulf Wahlgren

Journal:

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

Year:

1988

Language:

english

File:

PDF, 1.17 MB

english, 1988

50

Structure, bonding and redox properties of scandium oxide clusters, a model study

J.R.Tobias Johnson, Itai Panas

Journal:

Chemical Physics

Year:

1999

Language:

english

File:

PDF, 402 KB

english, 1999

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