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1

Volkswagen and quantum computing: An industrial perspective

Yarkoni, Sheir, Leib, Martin, Skolik, Andrea, Streif, Michael, Neukart, Florian, von Dollen, David

Journal:

Year:

2019

Language:

english

File:

PDF, 319 KB

english, 2019

2

[Springer Series in Chemical Physics] The Jahn-Teller Effect Volume 97 ||

Köppel, Horst, Yarkony, David R., Barentzen, Heinz

Year:

2010

Language:

english

File:

PDF, 28.70 MB

english, 2010

3

A Lippmann–Schwinger approach for the determination of photoionization and photodetachment cross sections based on a partial wave Green's function expansion and configuration interaction wave functions

Han, Seungsuk, Yarkony, David R.

Journal:

Molecular Physics

Year:

2012

Language:

english

File:

PDF, 246 KB

english, 2012

4

Cognitive neuroscience 2.0: building a cumulative science of human brain function

Tal Yarkoni, Russell A. Poldrack, David C. Van Essen, Tor D. Wager

Journal:

Trends in Cognitive Sciences

Year:

2010

Language:

english

File:

PDF, 463 KB

english, 2010

5

[Advanced Series in Physical Chemistry] Conical Intersections Volume 17 (Theory, Computation and Experiment) || Spin-Orbit Vibronic Coupling in Jahn–Teller Systems

Domcke, Wolfgang, Yarkony, David R, Köppel, Horst

Year:

2011

Language:

english

File:

PDF, 460 KB

english, 2011

6

[Advanced Series in Physical Chemistry] Conical Intersections Volume 17 (Theory, Computation and Experiment) || Femtosecond Pump-Probe Polarization Spectroscopy of Vibronic Dynamics at Conical Intersections and Funnels

Domcke, Wolfgang, Yarkony, David R, Köppel, Horst

Year:

2011

Language:

english

File:

PDF, 613 KB

english, 2011

7

On the evaluation of non-adiabatic coupling matrix elements for large scale CI wavefunctions

Paul Saxe, Byron H. Lengsfield III, David R. Yarkony

Journal:

Chemical Physics Letters

Year:

1985

Language:

english

File:

PDF, 339 KB

english, 1985

8

Nonadiabatic Quantum Chemistry—Past, Present, and Future

Yarkony, David R.

Journal:

Chemical Reviews

Year:

2012

Language:

english

File:

PDF, 711 KB

english, 2012

9

[Springer Series in Chemical Physics] The Jahn-Teller Effect Volume 97 || On the Vibronic Interactions in Aromatic Hydrocarbon Radicals and Radical Cations

Köppel, Horst, Yarkony, David R., Barentzen, Heinz

Year:

2010

Language:

english

File:

PDF, 1.07 MB

english, 2010

10

[Advanced Series in Physical Chemistry] Conical Intersections Volume 17 (Theory, Computation and Experiment) || Non-Born—Oppenheimer Molecular Dynamics for Conical Intersections, Avoided Crossings, and Weak Interactions

Domcke, Wolfgang, Yarkony, David R, Köppel, Horst

Year:

2011

Language:

english

File:

PDF, 936 KB

english, 2011

11

[Advanced Series in Physical Chemistry] Conical Intersections Volume 17 (Theory, Computation and Experiment) || Conical Intersections in Organic Photochemistry

Domcke, Wolfgang, Yarkony, David R, Köppel, Horst

Year:

2011

Language:

english

File:

PDF, 9.42 MB

english, 2011

12

[Advanced Series in Physical Chemistry] Conical Intersections Volume 17 (Theory, Computation and Experiment) || Efficient Excited-State Deactivation in Organic Chromophores and Biologically Relevant Molecules: Role of Electron and Proton Transfer Processes

Domcke, Wolfgang, Yarkony, David R, Köppel, Horst

Year:

2011

Language:

english

File:

PDF, 5.57 MB

english, 2011

13

[Advanced Series in Physical Chemistry] Conical Intersections Volume 17 (Theory, Computation and Experiment) || Symmetry Analysis of Geometric-Phase Effects in Quantum Dynamics

Domcke, Wolfgang, Yarkony, David R, Köppel, Horst

Year:

2011

Language:

english

File:

PDF, 617 KB

english, 2011

14

[Advanced Series in Physical Chemistry] Conical Intersections Volume 17 (Theory, Computation and Experiment) || Ab Initio Multiple Spawning: First Principles Dynamics Around Conical Intersections

Domcke, Wolfgang, Yarkony, David R, Köppel, Horst

Year:

2011

Language:

english

File:

PDF, 3.18 MB

english, 2011

15

[Advanced Series in Physical Chemistry] Conical Intersections Volume 17 (Theory, Computation and Experiment) || Computational and Methodological Elements for Nonadiabatic Trajectory Dynamics Simulations of Molecules

Domcke, Wolfgang, Yarkony, David R, Köppel, Horst

Year:

2011

Language:

english

File:

PDF, 1.19 MB

english, 2011

16

[Advanced Series in Physical Chemistry] Conical Intersections Volume 17 (Theory, Computation and Experiment) || Multistate Nonadiabatic Dynamics “on the Fly” in Complex Systems and Its Control by Laser Fieldes

Domcke, Wolfgang, Yarkony, David R, Köppel, Horst

Year:

2011

Language:

english

File:

PDF, 11.82 MB

english, 2011

17

[Advanced Series in Physical Chemistry] Conical Intersections Volume 17 (Theory, Computation and Experiment) || Conical Intersections Coupled to an Environment

Domcke, Wolfgang, Yarkony, David R, Köppel, Horst

Year:

2011

Language:

english

File:

PDF, 1.09 MB

english, 2011

18

[Advanced Series in Physical Chemistry] Conical Intersections Volume 17 (Theory, Computation and Experiment) || Nonadiabatic Trajectory Calculations with Ab Initio and Semiempirical Methods

Domcke, Wolfgang, Yarkony, David R, Köppel, Horst

Year:

2011

Language:

english

File:

PDF, 1.74 MB

english, 2011

19

[Advanced Series in Physical Chemistry] Conical Intersections Volume 17 (Theory, Computation and Experiment) || Exploring Nuclear Motion Through Conical Intersections in the UV Photodissociation of Azoles, Phenols and Related Systems

Domcke, Wolfgang, Yarkony, David R, Köppel, Horst

Year:

2011

Language:

english

File:

PDF, 1.57 MB

english, 2011

20

[Advanced Series in Physical Chemistry] Conical Intersections Volume 17 (Theory, Computation and Experiment) || Laser Control of Ultrafast Dynamics at Conical Intersections

Domcke, Wolfgang, Yarkony, David R, Köppel, Horst

Year:

2011

Language:

english

File:

PDF, 902 KB

english, 2011

21

[Advanced Series in Physical Chemistry] Conical Intersections Volume 17 (Theory, Computation and Experiment) || Pump-Probe Spectroscopy of Ultrafast Vibronic Dynamics in Organic Chromophores

Domcke, Wolfgang, Yarkony, David R, Köppel, Horst

Year:

2011

Language:

english

File:

PDF, 1.50 MB

english, 2011

22

[Advanced Series in Physical Chemistry] Conical Intersections Volume 17 (Theory, Computation and Experiment) || Interrogation of Nonadiabatic Molecular Dynamics via Time-Resolved Photoelectron Spectroscopy

Domcke, Wolfgang, Yarkony, David R, Köppel, Horst

Year:

2011

Language:

english

File:

PDF, 759 KB

english, 2011

23

On the intersection of two potential energy surfaces of the same symmetry. Systematic characterization using a Lagrange multiplier constrained procedure

Manaa, M. Riad, Yarkony, David R.

Journal:

The Journal of Chemical Physics

Year:

1993

Language:

english

File:

PDF, 713 KB

english, 1993

24

Polaritons in a spatially dispersive medium: Surface effects. I

Yarkony, David, Silbey, Robert

Journal:

Physical Review B

Year:

1978

Language:

english

File:

PDF, 505 KB

english, 1978

25

Spin-orbit coupling and conical intersections in molecules with an odd number of electrons. III. A perturbative determination of the electronic energies, derivative couplings and a rigorous diabatic representation near a conical intersection

Matsika, Spiridoula, Yarkony, David R.

Journal:

The Journal of Chemical Physics

Year:

2002

Language:

english

File:

PDF, 450 KB

english, 2002

26

Systematic determination of intersections of potential energy surfaces using a Lagrange multiplier constrained procedure

Yarkony, David R.

Journal:

Journal of Physical Chemistry

Year:

1993

Language:

english

File:

PDF, 1.11 MB

english, 1993

27

[Advanced Series in Physical Chemistry] Conical Intersections Volume 17 (Theory, Computation and Experiment) || FRONT MATTER

Domcke, Wolfgang, Yarkony, David R, Köppel, Horst

Year:

2011

Language:

english

File:

PDF, 167 KB

english, 2011

28

[Advanced Series in Physical Chemistry] Conical Intersections Volume 17 (Theory, Computation and Experiment) || BACK MATTER

Domcke, Wolfgang, Yarkony, David R, Köppel, Horst

Year:

2011

Language:

english

File:

PDF, 67 KB

english, 2011

29

Constructing diabatic representations using adiabatic and approximate diabatic data – Coping with diabolical singularities

Zhu, Xiaolei, Yarkony, David R.

Journal:

The Journal of Chemical Physics

Year:

2016

Language:

english

File:

PDF, 9.66 MB

english, 2016

30

Omphalocele in Miller-Dieker syndrome: Expanding the phenotype

Chitayat, David, Toi, Ants, Babul, Riyana, Blaser, Susan, Moola, Shiraz, Yarkoni, Daniel, Sermer, Mathew, Johnson, Jo-Ann, Vasjar, Jiri, Teshima, Ikuko

Journal:

American Journal of Medical Genetics

Year:

1997

Language:

english

File:

PDF, 594 KB

english, 1997

31

Diabatic bases and molecular properties

Eugene S. Kryachko, David R. Yarkony

Journal:

International Journal of Quantum Chemistry

Year:

2000

Language:

english

File:

PDF, 334 KB

english, 2000

32

Walsh diagram for zinc difluoride

David R. Yarkony, Henry F. Schaefer III

Journal:

Chemical Physics Letters

Year:

1972

Language:

english

File:

PDF, 430 KB

english, 1972

33

Multiplet splittings in the photoelectron spectra of organic radicals: Trimethylenemethane

David R. Yarkony, Henry F. Schaeffer III

Journal:

Chemical Physics Letters

Year:

1975

Language:

english

File:

PDF, 257 KB

english, 1975

34

Comment on the use of the augmented matrix in MCSCF theory

David R. Yarkony

Journal:

Chemical Physics Letters

Year:

1981

Language:

english

File:

PDF, 122 KB

english, 1981

35

On the characterization of the dipolar spin-spin interaction in molecular systems: A symbolic matrix element approach

James O. Jensen, David R. Yarkony

Journal:

Chemical Physics Letters

Year:

1987

Language:

english

File:

PDF, 569 KB

english, 1987

36

The mechanism of the reaction CH(X 2Π) + N2 (X 1Σ+g) → HCN (X 1Σ+) + N (4S).: II. The intermediate complex region

M. Riad Manaa, David R. Yarkony

Journal:

Chemical Physics Letters

Year:

1992

Language:

english

File:

PDF, 629 KB

english, 1992

37

Comment on the electronic structure of polydiacetylenes

David R. Yarkony

Journal:

Chemical Physics

Year:

1978

Language:

english

File:

PDF, 672 KB

english, 1978

38

On the multimode quadratic vibronic coupling problem: An open-ended solution using a parallel Lanczos algorithm

Michael S. Schuurman, Richard A. Young, David R. Yarkony

Journal:

Chemical Physics

Year:

2008

Language:

english

File:

PDF, 196 KB

english, 2008

39

On the role of conical intersections and their local topography in the photodissociation of the 1-hydroxyethyl radical

Kousik Samanta, David R. Yarkony

Journal:

Chemical Physics

Year:

2010

Language:

english

File:

PDF, 744 KB

english, 2010

40

Electronic structure and vertical excitation spectrum of methylene amidogen CH2N

George F. Adams, David R. Yarkony, Rodney J. Bartlett, George D. Purvis

Journal:

International Journal of Quantum Chemistry

Year:

1983

Language:

english

File:

PDF, 502 KB

english, 1983

41

On the quenching of Li(2p) by HCl: Nonadiabatic effects

David R. Yarkony

Journal:

International Journal of Quantum Chemistry

Year:

1987

Language:

english

File:

PDF, 402 KB

english, 1987

42

A criterion for the confluence of two seams of conical intersection in triatomic molecules

David R. Yarkony

Journal:

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

Year:

1998

Language:

english

File:

PDF, 437 KB

english, 1998

43

Quenching of Li (2P) by H2: potential energy surfaces, conical intersection seam, and diabatic bases

Eugene S. Kryachko, David R. Yarkony

Journal:

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

Year:

1998

Language:

english

File:

PDF, 871 KB

english, 1998

44

Perspective on “Some recent developments in the theory of molecular energy levels”

David R. Yarkony

Journal:

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

Year:

2000

Language:

english

File:

PDF, 139 KB

english, 2000

45

Moving beyond Coltheart’sN: A new measure of orthographic similarity

Tal Yarkoni, David Balota, Melvin Yap

Journal:

Psychonomic Bulletin & Review

Year:

2008

Language:

english

File:

PDF, 131 KB

english, 2008

46

Exploring media bias with semantic analysis tools: validation of the Contrast Analysis of Semantic Similarity (CASS)

Nicholas S. Holtzman, John Paul Schott, Michael N. Jones, David A. Balota, Tal Yarkoni

Journal:

Behavior Research Methods

Year:

2011

Language:

english

File:

PDF, 200 KB

english, 2011

47

Intersecting Conical Intersection Seams: Their Location, Representation, and Effect on Local Topography

Matsika, Spiridoula, Yarkony, David R.

Journal:

Journal of Physical Chemistry A

Year:

2002

Language:

english

File:

PDF, 265 KB

english, 2002

48

On the characterization of regions of avoided surface crossings using an analytic gradient based method

Yarkony, David R.

Journal:

The Journal of Chemical Physics

Year:

1990

Language:

english

File:

PDF, 948 KB

english, 1990

49

Conical Intersections: Diabolical and Often Misunderstood

Yarkony, David R.

Journal:

Accounts of Chemical Research

Year:

1998

Language:

english

File:

PDF, 251 KB

english, 1998

50

Role of Conical Intersections in Molecular Spectroscopy and Photoinduced Chemical Dynamics

Domcke, Wolfgang, Yarkony, David R.

Journal:

Annual Review of Physical Chemistry

Year:

2012

Language:

english

File:

PDF, 1.25 MB

english, 2012

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