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1

Electron transfer through organic molecular wires: A theoretical study

Lathiotakis, Nektarios N., Theodorakopoulos, Giannoula, Petsalakis, Ioannis D.

Journal:

Chemical Physics Letters

Year:

2017

Language:

english

File:

PDF, 1.00 MB

english, 2017

2

Peptide-mediated interactions in biological systems: new discoveries and applications

Evangelia Petsalaki, Robert B Russell

Journal:

Current Opinion in Biotechnology

Year:

2008

Language:

english

File:

PDF, 1.49 MB

english, 2008

3

Experimental and theoretical anion binding studies on coumarin linked thiourea and urea molecules

Kumaresh Ghosh, Suman Adhikari, Roland Fröhlich, Ioannis D. Petsalakis, Giannoula Theodorakopoulos

Journal:

Journal of Molecular Structure

Year:

2011

Language:

english

File:

PDF, 2.65 MB

english, 2011

4

Interaction Domains of Sos1/Grb2 Are Finely Tuned for Cooperative Control of Embryonic Stem Cell Fate

Findlay, Greg M., Smith, Matthew J., Lanner, Fredrik, Hsiung, Marilyn S., Gish, Gerald D., Petsalaki, Evangelia, Cockburn, Katie, Kaneko, Tomonori, Huang, Haiming, Bagshaw, Richard D., Ketela, Troy, T

Journal:

Year:

2013

Language:

english

File:

PDF, 1.71 MB

english, 2013

5

Tailoring the spacer type and length in push–pull chromophores. Insights from a systematic theoretical study

Kerkines, Ioannis S.K., Lathiotakis, Nektarios N., Theodorakopoulos, Giannoula, Petsalakis, Ioannis D.

Journal:

Chemical Physics Letters

Year:

2016

Language:

english

File:

PDF, 1.47 MB

english, 2016

6

Asymmetric binding of symmetric guests in a water-soluble cavitand

Yu, Yang, Zhang, Kang-da, Petsalakis, Ioannis D., Theodorakopoulos, Giannoula, Rebek, Julius

Journal:

Supramolecular Chemistry

Year:

2018

Language:

english

File:

PDF, 1.45 MB

english, 2018

7

Large-scale datasets uncovering cell signalling networks in cancer: context matters

Sharma, Sumana, Petsalaki, Evangelia

Journal:

Current Opinion in Genetics & Development

Year:

2019

Language:

english

File:

PDF, 723 KB

english, 2019

8

Photoinduced Electron Transfer on Aqueous Carbon Nanohorn–Pyrene–Tetrathiafulvalene Architectures

Georgia Pagona, Atula S. D. Sandanayaka, Alan Maigné, Jing Fan, George C. Papavassiliou, Ioannis D. Petsalakis, Barry R. Steele, Masako Yudasaka, Sumio Iijima, Nikos Tagmatarchis, Osamu Ito

Journal:

Chemistry - A European Journal

Year:

2007

Language:

english

File:

PDF, 431 KB

english, 2007

9

Bending potentials for H2O in the ground and the first six singlet excited states

Giannoula Theodorakopoulos, Ioannis D. Petsalakis, Robert J. Buenker, Sigrid D. Peyerimhoff

Journal:

Chemical Physics Letters

Year:

1984

Language:

english

File:

PDF, 354 KB

english, 1984

10

Theoretical investigation of the character of the electronic states of H2O along a linear dissociation path leading to OH + H

G. Theodorakopoulos, I.D. Petsalakis, R.J. Buenker

Journal:

Chemical Physics Letters

Year:

1987

Language:

english

File:

PDF, 463 KB

english, 1987

11

Non-adiabatic interactions between the C 2Σ+ and D 2Σ+ electronic states of HeH

G. Theodorakopoulos, I.D. Petsalakis, R.J. Buenker

Journal:

Chemical Physics Letters

Year:

1988

Language:

english

File:

PDF, 349 KB

english, 1988

12

An estimate of the lifetime of excited tetrahydrogen

I.D. Petsalakis, A. Metropoulos, G. Theodorakopoulos, C.A. Nicolaides

Journal:

Chemical Physics Letters

Year:

1989

Language:

english

File:

PDF, 303 KB

english, 1989

13

Theoretical calculations on the ground electronic state of HeNe+

I.D. Petsalakis, G. Theodorakopoulos, V.J. Barclay

Journal:

Chemical Physics Letters

Year:

1989

Language:

english

File:

PDF, 326 KB

english, 1989

14

Asymmetric dissociation and bending potentials of H2S in the ground and excited electronic states

Giannoula Theodorakopoulos, Ioannis D. Petsalakis

Journal:

Chemical Physics Letters

Year:

1991

Language:

english

File:

PDF, 617 KB

english, 1991

15

Theory and ab initio calculation of partial widths and interchannel coupling in predissociating diatomic states: application to HeF

I.D. Petsalakis, Th. Mercouris, G. Theodorakopoulos, C.A. Nicolaides

Journal:

Chemical Physics Letters

Year:

1991

Language:

english

File:

PDF, 534 KB

english, 1991

16

Theoretical calculations on the Rydberg states of H2S

Ioannis D. Petsalakis, Giannoula Theodorakopoulos

Journal:

Chemical Physics Letters

Year:

1992

Language:

english

File:

PDF, 543 KB

english, 1992

17

Above and below threshold multiphoton dissociation of volcanic ground states. Application to BeH2+

Nicolaides Cleanthes A., Mercouris Theodoros, Ioannis D. Petsalakis

Journal:

Chemical Physics Letters

Year:

1993

Language:

english

File:

PDF, 491 KB

english, 1993

18

Diabatic potentials for the 1 1A″ and 2 1A″ states of H2S

G. Theodorakopoulos, I.D. Petsalakis, C.A. Nicolaides

Journal:

Chemical Physics Letters

Year:

1993

Language:

english

File:

PDF, 361 KB

english, 1993

19

Time-dependent laser-induced molecular formation from repulsive surfaces

Theodoros Mercouris, Ioannis D. Petsalakis, Cleanthes A. Nicolaides

Journal:

Chemical Physics Letters

Year:

1993

Language:

english

File:

PDF, 523 KB

english, 1993

20

Electronic states and radiative transitions in LiAr

Jian-ping Gu, Gerhard Hirsch, Robert J. Buenker, Ioannis D. Petsalakis, Giannoula Theodorakopoulos, Ming-bao Huang

Journal:

Chemical Physics Letters

Year:

1994

Language:

english

File:

PDF, 577 KB

english, 1994

21

MRD CI calculations on the asymmetric stretch potentials of H2O in the ground and the first seven singlet excited states

Giannoula Theodorakopoulos, Ioannis D. Petsalakis, Robert J. Buenker

Journal:

Chemical Physics

Year:

1985

Language:

english

File:

PDF, 931 KB

english, 1985

22

Theoretical calculations on radiative and nonradiative processes of quartet states of HeH

I.D. Petsalakis, G. Theodorakopoulos

Journal:

Chemical Physics

Year:

1989

Language:

english

File:

PDF, 722 KB

english, 1989

23

MRD CI Calculations on the radiative lifetime of the a 2δ state of CH

G. Theodorakopoulos, I.D. Petsalakis, R.J. Buenker, M. Honigmann

Journal:

Chemical Physics

Year:

1989

Language:

english

File:

PDF, 477 KB

english, 1989

24

Crystallographic studies on N-azidoacetyl-β-d-glucopyranosylamine, an inhibitor of glycogen phosphorylase: Comparison with N-acetyl-β-d-glucopyranosylamine

Evangelia I. Petsalakis, Evangelia D. Chrysina, Costas Tiraidis, Theodoros Hadjiloi, Demetres D. Leonidas, Nikos G. Oikonomakos, Udayanath Aich, Babu Varghese, Duraikkannu Loganathan

Journal:

Bioorganic & Medicinal Chemistry

Year:

2006

Language:

english

File:

PDF, 637 KB

english, 2006

25

A consistent dielectric response model for water ice over the whole energy–momentum plane

D. Emfietzoglou, H. Nikjoo, I.D. Petsalakis, A. Pathak

Journal:

Nuclear Instruments and Methods in Physics Research Section B: Beam Interactions with Materials and Atoms

Year:

2007

Language:

english

File:

PDF, 445 KB

english, 2007

26

Quasi-molecular radiative transitions produced by thermal and low-temperature collisions: Ar(3p61S0–3p54s3P2)–He

A. Devdariani, E. Chesnokov, A. Zagrebin, M.G. Lednev, I.D. Petsalakis, G. Theodorakopoulos, H.-P. Liebermann, R.J. Buenker

Journal:

Chemical Physics

Year:

2006

Language:

english

File:

PDF, 596 KB

english, 2006

27

Structure and energetics of InN and GaN dimers

Lucia Šimová, Demeter Tzeli, Miroslav Urban, Ivan Černušák, Giannoula Theodorakopoulos, Ioannis D. Petsalakis

Journal:

Chemical Physics

Year:

2008

Language:

english

File:

PDF, 473 KB

english, 2008

28

Theoretical study of highly excited 1Σ+ and 1Π states of NaLi and experimental observation of the interacting 51Σ+ and 61Σ+ states

Ioannis D. Petsalakis, Giannoula Theodorakopoulos, Anna Grochol, Pawel Kowalczyk, Włodzimierz Jastrzebski

Journal:

Chemical Physics

Year:

2009

Language:

english

File:

PDF, 367 KB

english, 2009

29

Theoretical study on the electronic structure and the absorption spectra of complexes of C60 and C59N with π-extended derivatives of tetrathiafulvalene

Ioannis D. Petsalakis, Demeter Tzeli, Ioannis S.K. Kerkines, Giannoula Theodorakopoulos

Journal:

Computational and Theoretical Chemistry

Year:

2011

Language:

english

File:

PDF, 1.57 MB

english, 2011

30

Theoretical study on the low-lying electronic states of InN

Giannoula Theodorakopoulos, Ioannis D. Petsalakis

Journal:

Chemical Physics Letters

Year:

2006

Language:

english

File:

PDF, 242 KB

english, 2006

31

Unbalanced strain-directed functionalization of carbon nanohorns: A theoretical investigation based on complementary methods

Ioannis D. Petsalakis, Georgia Pagona, Giannoula Theodorakopoulos, Nikos Tagmatarchis, Masako Yudasaka, Sumio Iijima

Journal:

Chemical Physics Letters

Year:

2006

Language:

english

File:

PDF, 483 KB

english, 2006

32

Improved theoretical calculations of InN in its X3Σ− ground state and in the first 3Π excited state

Lukáš Demovič, Ivan Černušák, Giannoula Theodorakopoulos, Ioannis D. Petsalakis, Miroslav Urban

Journal:

Chemical Physics Letters

Year:

2007

Language:

english

File:

PDF, 355 KB

english, 2007

33

Theoretical study of adsorption of gallium and gallium nitrides on Si(1 1 1)

Demeter Tzeli, Ioannis D. Petsalakis, Giannoula Theodorakopoulos

Journal:

Chemical Physics Letters

Year:

2007

Language:

english

File:

PDF, 627 KB

english, 2007

34

Theoretical study in donor–acceptor carbon nanohorn-based hybrids

Ioannis D. Petsalakis, Georgia Pagona, Nikos Tagmatarchis, Giannoula Theodorakopoulos

Journal:

Chemical Physics Letters

Year:

2007

Language:

english

File:

PDF, 1.48 MB

english, 2007

35

Photoinduced charge transfer in fullerene–donor dyads: A theoretical study

Ioannis D. Petsalakis, Giannoula Theodorakopoulos

Journal:

Chemical Physics Letters

Year:

2008

Language:

english

File:

PDF, 495 KB

english, 2008

36

Emitting and electron-transfer electronic states of tertiary amine–fluorophore sensor systems

Ioannis D. Petsalakis, Ioannis S.K. Kerkines, Nektarios N. Lathiotakis, Giannoula Theodorakopoulos

Journal:

Chemical Physics Letters

Year:

2009

Language:

english

File:

PDF, 510 KB

english, 2009

37

Photoinduced charge transfer in heterofullerene–donor hybrids: A theoretical study

Ioannis Thanopulos, Ioannis D. Petsalakis, Giannoula Theodorakopoulos

Journal:

Chemical Physics Letters

Year:

2011

Language:

english

File:

PDF, 345 KB

english, 2011

38

Theoretical calculations on the potential energy curves of electronic states of CF: Rydberg states of CF above the lowest ionization limit

Ioannis D. Petsalakis, Giannoula Theodorakopoulos

Journal:

Chemical Physics Letters

Year:

2011

Language:

english

File:

PDF, 708 KB

english, 2011

39

Parent- and daughter-mediated halogenation reactions modeled for 1,2- and 1,4-dibromobenzene at Si(1 1 1)-7 × 7

K. Rajamma Harikumar, Ioannis D. Petsalakis, John C. Polanyi, Giannoula Theodorakopoulos

Journal:

Surface Science

Year:

2004

Language:

english

File:

PDF, 923 KB

english, 2004

40

Theoretical ab initio study on the electronic states of GaO and Ga2O

Ioannis D. Petsalakis, Giannoula Theodorakopoulos, Robert W. Gora, Szczepan Roszak

Journal:

Journal of Molecular Structure: THEOCHEM

Year:

2004

Language:

english

File:

PDF, 163 KB

english, 2004

41

Theoretical study on triphenylamine-based sensors of dicarboxylic acids

Ioannis D. Petsalakis, Nikos Tagmatarchis, George Rotas, Giannoula Theodorakopoulos

Journal:

Journal of Molecular Structure: THEOCHEM

Year:

2007

Language:

english

File:

PDF, 610 KB

english, 2007

42

Nearly diabatic states by maximization of the non-orthonormal overlap between model-diabatic and MRD-CI wavefunctions

I.D. Petsalakis, G. Theodorakopoulos, C.A. Nicolaides, R.J. Buenker

Journal:

Chemical Physics Letters

Year:

1991

Language:

english

File:

PDF, 512 KB

english, 1991

43

Complex coordinate calculations on autoionizing states of HeH and H2

Michael Honigmann, Gerhard Hirsch, Robert J. Buenker, Ioannis D. Petsalakis, Giannoula Theodorakopoulos

Journal:

Chemical Physics Letters

Year:

1999

Language:

english

File:

PDF, 145 KB

english, 1999

44

Corrigendum to “An ab initio potential energy surface and spectroscopic constants for the X1Σg+ state of NO2+”: [J. Mol. Struct. (Theochem) 434 (1998) 177–182]

Giannoula Theodorakopoulos, Ioannis D Petsalakis, Mark S Child

Journal:

Journal of Molecular Structure: THEOCHEM

Year:

2002

Language:

english

File:

PDF, 47 KB

english, 2002

45

Electronic states of CF+

Ioannis D. Petsalakis, G. Theodorakopoulos

Journal:

Chemical Physics

Year:

2000

Language:

english

File:

PDF, 206 KB

english, 2000

46

A method for the calculation of transition moments between electronic states of molecules using a different one-electron basis set for each state

G. Theodorakopoulos, I. D. Petsalakis, C. A. Nicolaides

Journal:

International Journal of Quantum Chemistry

Year:

1986

Language:

english

File:

PDF, 360 KB

english, 1986

47

Many-Electron, many-photon theory of nonstationary states

C. A. Nicolaides, T. H. Mercouris, Y. Komninos, I. D. Petsalakis

Journal:

International Journal of Quantum Chemistry

Year:

1994

Language:

english

File:

PDF, 527 KB

english, 1994

48

Configuration interaction study of the oscillator strenghts for the B1A1X1A1 and D1A1X1A1 transitions of the water molecule

Giannoula Theodorakopoulos, Ioannis D. Petsalakis, Cleanthes A. Nicolaides, Robert J. Buenker

Journal:

Chemical Physics

Year:

1985

Language:

english

File:

PDF, 719 KB

english, 1985

49

Non-orthonormal basis calculations of the dipole transition moment for the phillips system (A 1Πu → X 1Σ+g) in C2. Theoretical lifetime of the A 1Πu state

G. Theodorakopoulos, I.D. Petsalakis, C.A. Nicolaides, R.J. Buenker

Journal:

Chemical Physics

Year:

1987

Language:

english

File:

PDF, 640 KB

english, 1987

50

Computation of time-dependent transition probabilities in excimer molecules induced by femtosecond laser pulses

Ioannis D. Petsalakis, Theodoros Mercouris, Cleanthes A. Nicolaides

Journal:

Chemical Physics

Year:

1994

Language:

english

File:

PDF, 1.33 MB

english, 1994

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