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1

First-principles calculations of the stability and incorporation of helium, xenon and krypton in uranium

B. Beeler, B. Good, S. Rashkeev, C. Deo, M. Baskes, M. Okuniewski

Journal:

Journal of Nuclear Materials

Year:

2012

Language:

english

File:

PDF, 713 KB

english, 2012

2

A comprehensive risk assessment of toxic elements in international brands of face foundation powders

Shomar, Basem, Rashkeev, Sergey N.

Journal:

Environmental Research

Year:

2021

File:

PDF, 1.91 MB

2021

3

Performance, reliability, radiation effects, and aging issues in microelectronics – From atomic-scale physics to engineering-level modeling

Sokrates T. Pantelides, L. Tsetseris, M.J. Beck, S.N. Rashkeev, G. Hadjisavvas, I.G. Batyrev, B.R. Tuttle, A.G. Marinopoulos, X.J. Zhou, D.M. Fleetwood, R.D. Schrimpf

Journal:

Solid-State Electronics

Year:

2010

Language:

english

File:

PDF, 1.16 MB

english, 2010

4

Hydrogen in MOSFETs – A primary agent of reliability issues

Sokrates T. Pantelides, L. Tsetseris, S.N. Rashkeev, X.J. Zhou, D.M. Fleetwood, R.D. Schrimpf

Journal:

Microelectronics Reliability

Year:

2007

Language:

english

File:

PDF, 1.29 MB

english, 2007

5

Dopants adsorbed as single atoms prevent degradation of catalysts

Wang, Sanwu, Borisevich, Albina Y., Rashkeev, Sergey N., Glazoff, Michael V., Sohlberg, Karl, Pennycook, Stephen J., Pantelides, Sokrates T.

Journal:

Nature Materials

Year:

2004

Language:

english

File:

PDF, 370 KB

english, 2004

6

Dopants adsorbed as single atoms prevent degradation of catalysts

Wang, Sanwu, Borisevich, Albina Y., Rashkeev, Sergey N., Glazoff, Michael V., Sohlberg, Karl, Pennycook, Stephen J., Pantelides, Sokrates T.

Journal:

Nature Materials

Year:

2004

File:

PDF, 49 KB

2004

7

First-principles calculations of the optical properties of metals

Maksimov, E G, Mazin, I I, Rashkeev, S N, Uspenski, Yu A

Journal:

Journal of Physics F Metal Physics

Year:

1988

Language:

english

File:

PDF, 796 KB

english, 1988

8

Oxidation and hydrogen uptake in zirconium, Zircaloy-2 and Zircaloy-4: Computational thermodynamics and ab initio calculations

Glazoff, Michael V., Tokuhiro, Akira, Rashkeev, Sergey N., Sabharwall, Piyush

Journal:

Journal of Nuclear Materials

Year:

2014

Language:

english

File:

PDF, 2.93 MB

english, 2014

9

Ultra-high temperature steam corrosion of complex silicates for nuclear applications: A computational study

Rashkeev, Sergey N., Glazoff, Michael V., Tokuhiro, Akira

Journal:

Journal of Nuclear Materials

Year:

2014

Language:

english

File:

PDF, 1.83 MB

english, 2014

10

Efficient ab initio method for the calculation of frequency-dependent second-order optical response in semiconductors

Rashkeev, Sergey N., Lambrecht, Walter R. L., Segall, Benjamin

Journal:

Physical Review B

Year:

1998

Language:

english

File:

PDF, 261 KB

english, 1998

11

Reactions and Diffusion of Water and Oxygen Molecules in Amorphous

Bakos, T., Rashkeev, S. N., Pantelides, S. T.

Journal:

Physical Review Letters

Year:

2002

Language:

english

File:

PDF, 526 KB

english, 2002

12

Molecular Mechanisms of Shear Strain Sensitivity of the Energetic Crystals DADNE and TATB

Kuklja, Maija M., Rashkeev, Sergey N.

Journal:

Journal of Energetic Materials

Year:

2010

Language:

english

File:

PDF, 485 KB

english, 2010

13

B ( n =1,2,3): Aspects of universal behavior

Bratkovsky, A. M., Rashkeev, S. N., Wendin, G.

Journal:

Physical Review B

Year:

1993

Language:

english

File:

PDF, 547 KB

english, 1993

14

: Effects of inelastic scattering and interband transitions

Rashkeev, S. N., Wendin, G.

Journal:

Physical Review B

Year:

1993

Language:

english

File:

PDF, 224 KB

english, 1993

15

Low-energy interband transitions in

Mazin, I. I., Rashkeev, S. N., Liechtenstein, A. I., Andersen, O. K.

Journal:

Physical Review B

Year:

1992

Language:

english

File:

PDF, 252 KB

english, 1992

16

Effects of thermophoresis on dust accumulation on solar panels

Oh, Sangchul, Figgis, Benjamin W., Rashkeev, Sergey

Journal:

Year:

2020

File:

PDF, 1008 KB

2020

17

From Band Structures to Linear and Nonlinear Optical Spectra in Semiconductors

W.R.L. Lambrecht, S.N. Rashkeev

Journal:

physica status solidi (b)

Year:

2000

Language:

english

File:

PDF, 631 KB

english, 2000

18

Electronic Band Structure of SiC Polytypes: A Discussion of Theory and Experiment

W. R. L. Lambrecht, S. Limpijumnong, S. N. Rashkeev, B. Segall

Journal:

physica status solidi (b)

Year:

1997

Language:

english

File:

PDF, 466 KB

english, 1997

19

Dual Nanoparticle/Substrate Control of Catalytic Dehydrogenation

A. Y. Borisevich, S. Wang, S. N. Rashkeev, M. Glazoff, S. J. Pennycook, S. T. Pantelides

Journal:

Advanced Materials

Year:

2007

Language:

english

File:

PDF, 397 KB

english, 2007

20

Origin of Anomalous Pt–Pt Distances in the Pt/Alumina Catalytic System

Karl Sohlberg, Sergey Rashkeev, Albina Y. Borisevich, Stephen J. Pennycook, Sokrates T. Pantelides

Journal:

Year:

2004

Language:

english

File:

PDF, 189 KB

english, 2004

21

The dielectric screening and magnetic instabilities in an interacting electron gas

O.V. Dolgov, E.G. Maksimov, S.N. Rashkeev

Journal:

Solid State Communications

Year:

1983

Language:

english

File:

PDF, 190 KB

english, 1983

22

Effect of low symmetry on electron-phonon coupling in perovskite superconductors

I.I. Mazin, S.N. Rashkeev

Journal:

Solid State Communications

Year:

1988

Language:

english

File:

PDF, 186 KB

english, 1988

23

Temperature dependence of self-diffusion coefficients: Application to Cs

D. Fuks, J. Pelleg, S. Dorfman, S. Rashkeev

Journal:

Solid State Communications

Year:

1993

Language:

english

File:

PDF, 416 KB

english, 1993

24

On optical properties of quasicrystals and approximants

S.E. Burkov, S.N. Rashkeev

Journal:

Solid State Communications

Year:

1994

Language:

english

File:

PDF, 320 KB

english, 1994

25

Soft disorder effects in the conductance quantization in quantum point contacts: Indirect backscattering statistics

S.N. Rashkeev, A.M. Zagoskin, R.I. Shekhter, G. Wendin

Journal:

Solid State Communications

Year:

1996

Language:

english

File:

PDF, 594 KB

english, 1996

26

The electronic structure and optical properties of Ba1−xKxBiO3 and BaPb1−xBixO3 superconducting systems

A.M. Bratkovsky, S.N. Rashkeev

Journal:

Physics Letters A

Year:

1989

Language:

english

File:

PDF, 634 KB

english, 1989

27

Microscopic analysis of the transmittance of YBa2Cu3O7 thin films

I.I. Mazin, S.N. Rashkeev

Journal:

Physics Letters A

Year:

1990

Language:

english

File:

PDF, 318 KB

english, 1990

28

Microscopical calculations of the optical properties of Bi2Sr2CaCu2O8

Yu.A. Uspenskii, S.N. Rashkeev

Journal:

Physics Letters A

Year:

1991

Language:

english

File:

PDF, 354 KB

english, 1991

29

Laser detection of radiation enhanced electron transport in ultra-thin oxides

R. Pasternak, Y.V. Shirokaya, Z. Marka, J.K. Miller, S.N. Rashkeev, S.T. Pantelides, N.H. Tolk, B.K. Choi, R.D. Schrimpf, D.M. Fleetwood

Journal:

Nuclear Instruments and Methods in Physics Research Section A: Accelerators, Spectrometers, Detectors and Associated Equipment

Year:

2003

Language:

english

File:

PDF, 141 KB

english, 2003

30

Helium behavior in oxide nuclear fuels: First principles modeling

D. Gryaznov, S. Rashkeev, E.A. Kotomin, E. Heifets, Y. Zhukovskii

Journal:

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

Year:

2010

Language:

english

File:

PDF, 354 KB

english, 2010

31

Influence of local symmetry on the electron-phonon coupling in perovskites

I.I. Mazin, S.N. Rashkeev

Journal:

Physica C: Superconductivity

Year:

1989

Language:

english

File:

PDF, 152 KB

english, 1989

32

Catalytic activity of supported metal particles for sulfuric acid decomposition reaction

Sergey N. Rashkeev, Daniel M. Ginosar, Lucia M. Petkovic, Helen H. Farrell

Journal:

Catalysis Today

Year:

2009

Language:

english

File:

PDF, 2.86 MB

english, 2009

33

Ethanol oxidation on metal oxide-supported platinum catalysts

L.M. Petkovic, Sergey N. Rashkeev, D.M. Ginosar

Journal:

Catalysis Today

Year:

2009

Language:

english

File:

PDF, 1.24 MB

english, 2009

34

Single Hf atoms inside the ultrathin SiO2 interlayer between a HfO2 dielectric film and the Si substrate: How do they modify the interface?

S.N. Rashkeev, K. van Benthem, S.T. Pantelides, S.J. Pennycook

Journal:

Microelectronic Engineering

Year:

2005

Language:

english

File:

PDF, 363 KB

english, 2005

35

First-principles calculations of second-order optical response functions in chalcopyrite semiconductors

Walter R.L. Lambrecht, Sergey N. Rashkeev

Journal:

Journal of Physics and Chemistry of Solids

Year:

2003

Language:

english

File:

PDF, 193 KB

english, 2003

36

Quasiclassical theory of spontaneous currents at surfaces and interfaces of d-wave superconductors

M.H.S. Amin, A.N. Omelyanchouk, S.N. Rashkeev, M. Coury, A.M. Zagoskin

Journal:

Physica B: Condensed Matter

Year:

2002

Language:

english

File:

PDF, 339 KB

english, 2002

37

Spin/carrier dynamics at semiconductor interfaces using intense, tunable, ultra-fast lasers

Y. Jiang, R. Pasternak, Z. Marka, Y. V. Shirokaya, J. K. Miller, S. N. Rashkeev, Yu. D. Glinka, I. E. Perakis, P. K. Roy, J. Kozub, B. K. Choi, D. M. Fleetwood, R. D. Schrimpf, X. Liu, Y. Sasaki, J. K

Journal:

physica status solidi (b)

Year:

2003

Language:

english

File:

PDF, 496 KB

english, 2003

38

Light scattering from rough surfaces with superimposed periodic structures

M.V. Glazov, S.N. Rashkeev

Journal:

Applied Physics B: Lasers and Optics

Year:

1998

Language:

english

File:

PDF, 224 KB

english, 1998

39

Implementing first principles calculations of defect migration in a fuel performance code for UN simulations

E.A. Kotomin, Yu.A. Mastrikov, S.N. Rashkeev, P. Van Uffelen

Journal:

Journal of Nuclear Materials

Year:

2009

Language:

english

File:

PDF, 2.59 MB

english, 2009

40

Role of the nanoscale in catalytic CO oxidation by supported Au and Pt nanostructures

Rashkeev, Sergey, Lupini, Andrew, Overbury, Steven, Pennycook, Stephen, Pantelides, Sokrates

Journal:

Physical Review B

Year:

2007

Language:

english

File:

PDF, 989 KB

english, 2007

41

Phase transformation mechanism between γ- and θ-alumina

Cai, Shu-Hui, Rashkeev, Sergey, Pantelides, Sokrates, Sohlberg, Karl

Journal:

Physical Review B

Year:

2003

Language:

english

File:

PDF, 790 KB

english, 2003

42

Atomic Scale Mechanism of the Transformation of γ-Alumina to θ-Alumina

Rashkeev, Sergey, Pantelides, Sokrates, Sohlberg, Karl, Cai, Shu-Hui

Journal:

Physical Review Letters

Year:

2002

Language:

english

File:

PDF, 532 KB

english, 2002

43

d+is versus d+id′ time reversal symmetry breaking states in finite size systems

Omelyanchouk, A., Zagoskin, A., Amin, M., Rashkeev, S., Coury, M.

Journal:

Physical Review B

Year:

2002

Language:

english

File:

PDF, 315 KB

english, 2002

44

First principles calculations for defects in U

Beeler, B, Good, B, Rashkeev, S, Deo, C, Baskes, M, Okuniewski, M

Journal:

Journal of Physics Condensed Matter

Year:

2010

Language:

english

File:

PDF, 433 KB

english, 2010

45

Interband transitions and electronic Raman continuum in systems with strong inelastic scattering: Applications to YBa2Cu3O7-δ

S. N. Rashkeev, G. Wendin

Journal:

Zeitschrift für Physik B Condensed Matter

Year:

1993

Language:

english

File:

PDF, 1.18 MB

english, 1993

46

The curvature of the self-diffusion Arrhenius plot through the mono-vacancy mechanism

D. Fuks, J. Pelleg, S. N. Rashkeev, S. Dorfman

Journal:

Zeitschrift für Physik B Condensed Matter

Year:

1994

Language:

english

File:

PDF, 778 KB

english, 1994

47

Calculations of vacancy formation and migration energies offccCs by the LMTO-method: Application to self diffusion

D. Fuks, J. Pelleg, S. N. Rashkeev, S. Dorfman

Journal:

Zeitschrift für Physik B Condensed Matter

Year:

1993

Language:

english

File:

PDF, 566 KB

english, 1993

48

Microscopic analysis of the characteristic energy loss spectra of 3d-and 4d-transition metal carbides and nitrides

A. G. Nagizyan, S. N. Rashkeev

Journal:

Zeitschrift für Physik B Condensed Matter

Year:

1991

Language:

english

File:

PDF, 391 KB

english, 1991

49

Calculations of the optical properties of metals by LMTO method

Yu. A. Uspenski, E. G. Maksimov, S. N. Rashkeev, I. I. Mazin

Journal:

Zeitschrift für Physik B Condensed Matter

Year:

1983

Language:

english

File:

PDF, 566 KB

english, 1983

50

Atomic-scale mechanisms of oxygen electrode delamination in solid oxide electrolyzer cells

Sergey N. Rashkeev, Michael V. Glazoff

Journal:

International Journal of Hydrogen Energy

Year:

2012

Language:

english

File:

PDF, 1.24 MB

english, 2012