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1

Flux analysis for calculating reaction probabilities with real wave packets

Anthony J.H.M. Meijer, Evelyn M. Goldfield, Stephen K. Gray, Gabriel G. Balint-Kurti

Journal:

Chemical Physics Letters

Year:

1998

Language:

english

File:

PDF, 84 KB

english, 1998

2

Dispersion fitted finite difference method with applications to molecular quantum mechanics

Gray, Stephen K., Goldfield, Evelyn M.

Journal:

The Journal of Chemical Physics

Year:

2001

Language:

english

File:

PDF, 410 KB

english, 2001

3

An OpenMP/MPI approach to the parallelization of iterative four-atom quantum mechanics

Dmitry M. Medvedev, Evelyn M. Goldfield, Stephen K. Gray

Journal:

Computer Physics Communications

Year:

2005

Language:

english

File:

PDF, 252 KB

english, 2005

4

Vibrational predissociation from different asymmetric rotor levels: full dimensional quantum dynamics for ArI2 with total angular momentum J = 10

Evelyn M. Goldfield, Stephen K. Gray

Journal:

Chemical Physics Letters

Year:

1997

Language:

english

File:

PDF, 659 KB

english, 1997

5

Time-dependent quantum mechanical calculations on H+O[sub 2] for total angular momentum J>0. III. Total cross sections

Goldfield, Evelyn M., Meijer, Anthony J. H. M.

Journal:

The Journal of Chemical Physics

Year:

2000

Language:

english

File:

PDF, 523 KB

english, 2000

6

Classical Trajectory Studies of the D + H 2 → HD + H Reaction Confined in Carbon Nanotubes: Parallel Trajectories

Lu, Tun, Goldfield, Evelyn M., Gray, Stephen K.

Journal:

The Journal of Physical Chemistry C

Year:

2008

Language:

english

File:

PDF, 983 KB

english, 2008

7

Classical Trajectory Studies of the D + H 2 → HD + H Reaction Confined in Carbon Nanotubes: Effects of Collisions with the Nanotube Walls

Lu, Tun, Goldfield, Evelyn M., Gray, Stephen K.

Journal:

The Journal of Physical Chemistry C

Year:

2010

Language:

english

File:

PDF, 2.10 MB

english, 2010

8

Dynamics of the H + O 2 → O + OH Chain-Branching Reaction: Accurate Quantum Mechanical and Experimental Absolute Reaction Cross Sections

Abu Bajeh, Mohammed, Goldfield, Evelyn M., Hanf, Alexander, Kappel, Christoph, Meijer, Anthony J. H. M., Volpp, Hans-Robert, Wolfrum, Jürgen

Journal:

Journal of Physical Chemistry A

Year:

2001

Language:

english

File:

PDF, 105 KB

english, 2001

9

Coriolis-Coupled Quantum Dynamics for O( 1 D) + H 2 → OH + H †

Carroll, Thomas E., Goldfield, Evelyn M.

Journal:

Journal of Physical Chemistry A

Year:

2001

Language:

english

File:

PDF, 105 KB

english, 2001

10

Stereoelectronic effects in the reactions of phosphate diesters, phosphoramidates, and phosphonates. 3. Ab initio molecular orbital calculations of transition states

Gorenstein, David G., Luxon, Bruce A., Goldfield, Evelyn M.

Journal:

Journal of the American Chemical Society

Year:

1980

Language:

english

File:

PDF, 408 KB

english, 1980

11

Highly Excited Bound and Low-Lying Resonance States of H 2 O †

Gray, Stephen K., Goldfield, Evelyn M.

Journal:

Journal of Physical Chemistry A

Year:

2001

Language:

english

File:

PDF, 122 KB

english, 2001

12

Quantum States of Hydrogen and Its Isotopes Confined in Single-Walled Carbon Nanotubes: Dependence on Interaction Potential and Extreme Two-Dimensional Confinement

Lu, Tun, Goldfield, Evelyn M., Gray, Stephen K.

Journal:

Journal of Physical Chemistry B

Year:

2006

Language:

english

File:

PDF, 167 KB

english, 2006

13

High-resolution phosphorus nuclear magnetic resonance spectra of yeast phenylalanine transfer ribonucleic acid. Metal ion effects and tentative partial assignment of signals

Gorenstein, David G., Goldfield, Evelyn M., Chen, Roulhwai, Kovar, Ken, Luxon, Bruce A.

Journal:

Year:

1981

Language:

english

File:

PDF, 1.76 MB

english, 1981

14

Phosphorus-31 nuclear magnetic resonance of ethidium complexes with ribonucleic acid model systems and phenylalanine-specific transfer ribonucleic acid

Goldfield, Evelyn M., Luxon, Bruce A., Bowie, Vickie, Gorenstein, David G.

Journal:

Year:

1983

Language:

english

File:

PDF, 1.70 MB

english, 1983

15

Phosphorus-31 NMR of double- and triple-helical nucleic acids

Gorenstein, David G., Luxon, Bruce A., Goldfield, Evelyn M., Lai, Kofen, Vegeais, Donna

Journal:

Year:

1982

Language:

english

File:

PDF, 1.05 MB

english, 1982

16

High-resolution phosphorus nuclear magnetic resonance spectroscopy of transfer ribonucleic acids: multiple conformations in the anticodon loop

Gorenstein, David G., Goldfield, Evelyn M.

Journal:

Year:

1982

Language:

english

File:

PDF, 1.97 MB

english, 1982

17

Quantum Mechanical Capture/Phase Space Theory Calculation of the Rate Constants for the Complex-Forming CH + H 2 Reaction

Saracibar, Amaia, Goldfield, Evelyn M., Gray, Stephen K.

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 1.31 MB

english, 2008

18

Theoretical Study of the Complex-Forming CH + H 2 → CH 2 + H Reaction †

Mayneris, Jordi, Saracibar, Amaia, Goldfield, Evelyn M., González, Miguel, García, Ernesto, Gray, Stephen K.

Journal:

Journal of Physical Chemistry A

Year:

2006

Language:

english

File:

PDF, 102 KB

english, 2006

19

Quantum States of Molecular Hydrogen and Its Isotopes in Single-Walled Carbon Nanotubes

Lu, Tun, Goldfield, Evelyn M., Gray, Stephen K.

Journal:

Journal of Physical Chemistry B

Year:

2003

Language:

english

File:

PDF, 171 KB

english, 2003

20

Quantum reactive scattering of O(1D)+H2 and O(1D)+HD

Balint-Kurti, Gabriel G., Gonzalez, Ana I., Goldfield, Evelyn M., Gray, Stephen K.

Journal:

Faraday Discussions

Year:

1998

Language:

english

File:

PDF, 223 KB

english, 1998

21

Time-dependent quantum mechanical calculations on H + O2 for total angular momentum J > 0: Comparing different dynamical approximations

M. Meijer, Anthony J. H., Goldfield, Evelyn M.

Journal:

Physical Chemistry Chemical Physics

Year:

2001

Language:

english

File:

PDF, 272 KB

english, 2001

22

Quantum dynamical study of the Cl-+CH3Br SN2 reaction

Wang, Haobin, Goldfield, Evelyn M., Hase, William L.

Journal:

Journal of the Chemical Society Faraday Transactions

Year:

1997

Language:

english

File:

PDF, 435 KB

english, 1997

23

Total angular momentum and decay of unimolecular resonances IVR-mediated vibrational predissociation

Goldfield, Evelyn M., Gray, Stephen K.

Journal:

Journal of the Chemical Society Faraday Transactions

Year:

1997

Language:

english

File:

PDF, 518 KB

english, 1997

24

Quantum dynamics of the trimethylene biradical Stereomutation of cyclopropane and unimolecular decay

Goldfield, Evelyn M.

Journal:

Faraday Discussions

Year:

1998

Language:

english

File:

PDF, 426 KB

english, 1998

25

Helicity decoupled quantum dynamics and capture model cross sections and rate constants for O(1D)+H2→OH+H

Gray, Stephen K., Goldfield, Evelyn M., Schatz, George C., Balint-Kurti, Gabriel G.

Journal:

Physical Chemistry Chemical Physics

Year:

1999

Language:

english

File:

PDF, 180 KB

english, 1999

26

Determination of the optimum number of bins to use in a histogrammic representation of a probability density function

Gislason, Eric A., Goldfield, Evelyn M.

Journal:

The Journal of Chemical Physics

Year:

1984

Language:

english

File:

PDF, 499 KB

english, 1984

27

Ab initio studies of low-lying 3Σ−, 3Π, and 5Σ− states of NH. I. Potential curves and dipole moment functions

Goldfield, Evelyn M., Kirby, Kate P.

Journal:

The Journal of Chemical Physics

Year:

1987

Language:

english

File:

PDF, 886 KB

english, 1987

28

Quantum dynamics of vibrationally activated OH–CO reactant complexes

He, Yong, Goldfield, Evelyn M., Gray, Stephen K.

Journal:

The Journal of Chemical Physics

Year:

2004

Language:

english

File:

PDF, 319 KB

english, 2004

29

Quantum wave packet and quasiclassical trajectory studies of OH+CO: Influence of the reactant channel well on thermal rate constants

Medvedev, Dmitry M., Gray, Stephen K., Goldfield, Evelyn M., Lakin, Matthew J., Troya, Diego, Schatz, George C.

Journal:

The Journal of Chemical Physics

Year:

2004

Language:

english

File:

PDF, 351 KB

english, 2004

30

Time-dependent quantum mechanical calculations on H+O[sub 2] for total angular momentum J>0 II: On the importance of Coriolis coupling

Meijer, Anthony J. H. M., Goldfield, Evelyn M.

Journal:

The Journal of Chemical Physics

Year:

1999

Language:

english

File:

PDF, 463 KB

english, 1999

31

Trajectory studies of OH vibrational excitation propensities in the reaction of O(1D) with H2

Goldfield, Evelyn M., Wiesenfeld, John R.

Journal:

The Journal of Chemical Physics

Year:

1990

Language:

english

File:

PDF, 1.05 MB

english, 1990

32

state produced in charge-transfer collisions of

Gislason, Eric A., Goldfield, Evelyn M.

Journal:

Physical Review A

Year:

1982

Language:

english

File:

PDF, 246 KB

english, 1982

33

Quantum reactive scattering calculations of cross sections and rate constants for the N([sup 2]D)+O[sub 2](X [sup 3]Σ[sub g][sup −])→O([sup 3]P)+NO(X [sup 2]Π) reaction

Miquel, Irene, González, Miguel, Sayós, R., Balint-Kurti, Gabriel G., Gray, Stephen K., Goldfield, Evelyn M.

Journal:

The Journal of Chemical Physics

Year:

2003

Language:

english

File:

PDF, 487 KB

english, 2003

34

A quantum dynamics study of H[sub 2]+OH→H[sub 2]O+H employing the Wu–Schatz–Lendvay–Fang–Harding potential function and a four-atom implementation of the real wave packet method

Goldfield, Evelyn M., Gray, Stephen K.

Journal:

The Journal of Chemical Physics

Year:

2002

Language:

english

File:

PDF, 371 KB

english, 2002

35

Wave packet dynamics of vibrational quenching in collisions of Kr and O2+

Goldfield, Evelyn M.

Journal:

The Journal of Chemical Physics

Year:

1992

Language:

english

File:

PDF, 1.30 MB

english, 1992

36

Theoretical study of the radiative properties of the triplet states of the NH radical: Transition dipole moments, radiative lifetimes, photodissociation cross sections

Kirby, Kate P., Goldfield, Evelyn M.

Journal:

The Journal of Chemical Physics

Year:

1991

Language:

english

File:

PDF, 707 KB

english, 1991

37

Quantum dynamics of Renner–Teller vibronic coupling: The predissociation of HCO

Goldfield, Evelyn M., Gray, Stephen K., Harding, Lawrence B.

Journal:

The Journal of Chemical Physics

Year:

1993

Language:

english

File:

PDF, 1.51 MB

english, 1993

38

Anatomy of a vertical metal halide discharge

Dakin, James T., Rautenberg, Theodore H., Goldfield, Evelyn M.

Journal:

Journal of Applied Physics

Year:

1989

Language:

english

File:

PDF, 1.88 MB

english, 1989

39

Time-dependent quantum mechanical calculations on H+O[sub 2] for total angular momentum J>0

Meijer, Anthony J. H. M., Goldfield, Evelyn M.

Journal:

The Journal of Chemical Physics

Year:

1998

Language:

english

File:

PDF, 473 KB

english, 1998

40

Calculation of the reactive cross section for alkali atoms reacting with bromine molecules

Goldfield, Evelyn M., Kosmas, Agni M., Gislason, Eric A.

Journal:

The Journal of Chemical Physics

Year:

1985

Language:

english

File:

PDF, 778 KB

english, 1985

41

Quantum dynamics of a planar model for the complex forming OH+CO→H+CO2 reaction

Goldfield, Evelyn M., Gray, Stephen K., Schatz, George C.

Journal:

The Journal of Chemical Physics

Year:

1995

Language:

english

File:

PDF, 526 KB

english, 1995

42

THE EQUILIBRIUM CONSTANTS FOR MOLECULAR HYDROGEN ADSORPTION IN CARBON NANOTUBES BASED ON ITERATIVELY DETERMINED NANO-CONFINED BOUND STATES

LU, TUN, GOLDFIELD, EVELYN M., GRAY, STEPHEN K.

Journal:

Journal of Theoretical and Computational Chemistry

Year:

2003

Language:

english

File:

PDF, 204 KB

english, 2003

43

Quantum dynamics study of the dissociative photodetachment of HOCO[sup −]

Zhang, Shesheng, Medvedev, Dmitry M., Goldfield, Evelyn M., Gray, Stephen K.

Journal:

The Journal of Chemical Physics

Year:

2006

Language:

english

File:

PDF, 193 KB

english, 2006

44

[IEEE 2017 International Conference on Rehabilitation Robotics (ICORR) - London, United Kingdom (2017.7.17-2017.7.20)] 2017 International Conference on Rehabilitation Robotics (ICORR) - Design and preliminary evaluation of a multi-robotic system with pelvic and hip assistance for pediatric gait rehabilitation

Park, Evelyn J., Kang, Jiyeon, Su, Hao, Stegall, Paul, Miranda, Daniel L., Hsu, Wen-Hao, Karabas, Mustafa, Phipps, Nathan, Agrawal, Sunil K., Goldfield, Eugene C., Walsh, Conor J.

Year:

2017

Language:

english

File:

PDF, 1.45 MB

english, 2017

45

Gait Initiation of New Walkers and the Adult’s Role in Regulating Directionality of the Child’s Body Motion

Hsu, Wen-Hao, Park, Evelyn J, Miranda, Daniel L, Sallum, Hani M, Walsh, Conor J, Goldfield, Eugene C

Journal:

Journal of Motor Learning and Development

Year:

2018

Language:

english

File:

PDF, 874 KB

english, 2018

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