S. Gezelter: search on Z-Library

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1

Is the Ewald summation still necessary? Pairwise alternatives to the accepted standard for long-range electrostatics

Fennell, Christopher J., Gezelter, J. Daniel

Journal:

The Journal of Chemical Physics

Year:

2006

Language:

english

File:

PDF, 917 KB

english, 2006

2

Dendritic cells exposed to human immunodeficiency virus type-1 transmit a vigorous cytopathic infection to CD4+ T cells

Cameron, P., Freudenthal, P., Barker, J., Gezelter, S, Inaba, K, Steinman, R.

Journal:

Year:

1992

Language:

english

File:

PDF, 1.86 MB

english, 1992

3

Use of the fluorescence activated cell sorter to enrich dendritic cells from mouse spleen

Mary T. Crowley, Kayo Inaba, Margit D. Witmer-Pack, Stuart Gezelter, Ralph M. Steinman

Journal:

Journal of Immunological Methods

Year:

1990

Language:

english

File:

PDF, 905 KB

english, 1990

4

Friction at Ice-I h / Water Interfaces Is Governed by Solid / Liquid Hydrogen-Bonding

Louden, Patrick B., Gezelter, J. Daniel

Journal:

The Journal of Physical Chemistry C

Year:

2017

Language:

english

File:

PDF, 18.63 MB

english, 2017

5

Velocity shearing and scaling RNEMD: a minimally perturbing method for simulating temperature and momentum gradients

Kuang, Shenyu, Gezelter, J. Daniel

Journal:

Molecular Physics

Year:

2012

Language:

english

File:

PDF, 385 KB

english, 2012

6

Simulating Interfacial Thermal Conductance at Metal-Solvent Interfaces: The Role of Chemical Capping Agents

Kuang, Shenyu, Gezelter, J. Daniel

Journal:

The Journal of Physical Chemistry C

Year:

2011

Language:

english

File:

PDF, 3.73 MB

english, 2011

7

Dynamics of the photodissociation of triplet ketene

Gezelter, J. Daniel, Miller, William H.

Journal:

The Journal of Chemical Physics

Year:

1996

Language:

english

File:

PDF, 372 KB

english, 1996

8

Molecular Dynamics Simulations of the Surface Reconstructions of Pt(557) and Au(557) under Exposure to CO

Michalka, Joseph R., McIntyre, Patrick W., Gezelter, J. Daniel

Journal:

The Journal of Physical Chemistry C

Year:

2013

Language:

english

File:

PDF, 1.12 MB

english, 2013

9

Why is Ice Slippery? Simulations of Shear Viscosity of the Quasi-Liquid Layer on Ice

Louden, Patrick B., Gezelter, J. Daniel

Journal:

The Journal of Physical Chemistry Letters

Year:

2018

Language:

english

File:

PDF, 1.01 MB

english, 2018

10

Reverse Non-Equilibrium Molecular Dynamics Demonstrate That Surface Passivation Controls Thermal Transport at Semiconductor–Solvent Interfaces

Hannah, Daniel C., Gezelter, J. Daniel, Schaller, Richard D., Schatz, George C.

Journal:

Year:

2015

Language:

english

File:

PDF, 1.63 MB

english, 2015

11

Langevin dynamics for rigid bodies of arbitrary shape

Sun, Xiuquan, Lin, Teng, Gezelter, J. Daniel

Journal:

The Journal of Chemical Physics

Year:

2008

Language:

english

File:

PDF, 1.05 MB

english, 2008

12

Thermal Transport is Influenced by Nanoparticle Morphology: A Molecular Dynamics Study

Neidhart, Suzanne M., Gezelter, J. Daniel

Journal:

The Journal of Physical Chemistry C

Year:

2017

Language:

english

File:

PDF, 4.33 MB

english, 2017

13

A search for the ge0-meson

J. Gezelter, S. Lichtman, F. J. Loeffler, R. J. Miller, R. B. Willmann

Journal:

Il Nuovo Cimento A (1971-1996)

Year:

1968

Language:

english

File:

PDF, 415 KB

english, 1968

14

Dipolar Ordering in the Ripple Phases of Molecular-Scale Models of Lipid Membranes

Sun, Xiuquan, Gezelter, J. Daniel

Journal:

Journal of Physical Chemistry B

Year:

2008

Language:

english

File:

PDF, 553 KB

english, 2008

15

Conjugates of dendritic cells and memory T lymphocytes from skin facilitate productive infection with HIV-1

M. Pope, M.G.H. Betjes, N. Romani, H. Hirmand, P.U. Cameron, L. Hoffman, S. Gezelter, G. Schuler, R.M. Steinman

Journal:

Year:

1994

Language:

english

File:

PDF, 3.80 MB

english, 1994

16

Calculating the hopping rate for self-diffusion on rough potential energy surfaces: Cage correlations

Rabani, Eran, Gezelter, J. Daniel, Berne, B. J.

Journal:

The Journal of Chemical Physics

Year:

1997

Language:

english

File:

PDF, 435 KB

english, 1997

17

Evidence for stepwise dissociation dynamics in acetone at 248 and 193 nm

North, Simon W., Blank, David A., Gezelter, J. Daniel, Longfellow, Cheryl A., Lee, Yuan T.

Journal:

The Journal of Chemical Physics

Year:

1995

Language:

english

File:

PDF, 626 KB

english, 1995

18

Calculating the hopping rate for diffusion in molecular liquids: CS[sub 2]

Gezelter, J. Daniel, Rabani, Eran, Berne, B. J.

Journal:

The Journal of Chemical Physics

Year:

1999

Language:

english

File:

PDF, 424 KB

english, 1999

19

OOPSE: An object-oriented parallel simulation engine for molecular dynamics

Matthew A. Meineke, Charles F. Vardeman II, Teng Lin, Christopher J. Fennell, J. Daniel Gezelter

Journal:

Journal of Computational Chemistry

Year:

2005

Language:

english

File:

PDF, 275 KB

english, 2005

20

Use of neural networks to design shaped radiofrequency pulses

J.Daniel Gezelter, Ray Freeman

Journal:

Journal of Magnetic Resonance (1969)

Year:

1969

Language:

english

File:

PDF, 450 KB

english, 1969

21

Mesons from Beryllium at 0.97

Gezelter, J., Salmon, G. L., Murphy, F. V., O'Neill, G. K., Grismore, R.

Journal:

Physical Review (Series I)

Year:

1968

Language:

english

File:

PDF, 1.88 MB

english, 1968

22

Response to “Comment on a critique of the instantaneous normal mode (INM) approach to diffusion” [J. Chem. Phys. 109 , 4693 (1998)]

Gezelter, J. Daniel, Rabani, Eran, Berne, B. J.

Journal:

The Journal of Chemical Physics

Year:

1998

Language:

english

File:

PDF, 276 KB

english, 1998

23

Computational Free Energy Studies of a New Ice Polymorph Which Exhibits Greater Stability than Ice I h

Fennell, Christopher J., Gezelter, J. Daniel

Journal:

Journal of Chemical Theory and Computation

Year:

2005

Language:

english

File:

PDF, 268 KB

english, 2005

24

Spontaneous corrugation of dipolar membranes

Sun, Xiuquan, Gezelter, J. Daniel

Journal:

Physical Review E

Year:

2007

Language:

english

File:

PDF, 323 KB

english, 2007

25

CO-Induced Restructuring on Stepped Pt Surfaces: A Molecular Dynamics Study

Michalka, Joseph R., Latham, Andrew P., Gezelter, J. Daniel

Journal:

The Journal of Physical Chemistry C

Year:

2016

Language:

english

File:

PDF, 5.71 MB

english, 2016

26

Real space electrostatics for multipoles. III. Dielectric properties

Lamichhane, Madan, Parsons, Thomas, Newman, Kathie E., Gezelter, J. Daniel

Journal:

The Journal of Chemical Physics

Year:

2016

Language:

english

File:

PDF, 789 KB

english, 2016

27

Direct Observation of Stretched-Exponential Relaxation in Low-Temperature Lennard-Jones Systems Using the Cage Correlation Function

Rabani, Eran, Gezelter, J. Daniel, Berne, B. J.

Journal:

Physical Review Letters

Year:

1999

Language:

english

File:

PDF, 156 KB

english, 1999

28

Random Sequential Adsorption Model for the Differential Coverage of Gold (111) Surfaces by Two Related Silicon Phthalocyanines †

Meineke, Matthew A., Gezelter, J. Daniel

Journal:

Journal of Physical Chemistry B

Year:

2001

Language:

english

File:

PDF, 204 KB

english, 2001

29

Breathing Mode Dynamics and Elastic Properties of Gold Nanoparticles

Vardeman, Charles F., Conforti, Patrick F., Sprague, Megan M., Gezelter, J. Daniel

Journal:

Journal of Physical Chemistry B

Year:

2005

Language:

english

File:

PDF, 123 KB

english, 2005

30

Infection and Apoptotic Cell Death of CD4 + T Cells during an Immune Response to HIV-1-Pulsed Dendritic Cells

CAMERON, P. U., POPE, M., GEZELTER, S., STEINMAN, R. M.

Journal:

AIDS Research and Human Retroviruses

Year:

1994

Language:

english

File:

PDF, 9.93 MB

english, 1994

31

Island Formation on Pt/Pd(557) Surface Alloys in the Presence of Adsorbed CO: A Molecular Dynamics Study

Michalka, Joseph R., Gezelter, J. Daniel

Journal:

The Journal of Physical Chemistry C

Year:

2015

Language:

english

File:

PDF, 5.30 MB

english, 2015

32

Some problems of correcting the zero-point energy problem in classical trajectories

Thomas D. Sewell, Donald L. Thompson, J.Daniel Gezelter, William H. Miller

Journal:

Chemical Physics Letters

Year:

1992

Language:

english

File:

PDF, 508 KB

english, 1992

33

Can imaginary instantaneous normal mode frequencies predict barriers to self-diffusion?

Gezelter, J. Daniel, Rabani, Eran, Berne, B. J.

Journal:

The Journal of Chemical Physics

Year:

1997

Language:

english

File:

PDF, 469 KB

english, 1997

34

Susceptibility of dendritic cells to HIV-1 infection in vitro

Cameron, Paul U., Lowe, Melinda G., Crowe, Suzanne M., O'Doherty, Una, Pope, Melissa, Gezelter, Stuart, Steinman, Ralph M.

Journal:

Journal of Leukocyte Biology

Year:

1994

Language:

english

File:

PDF, 1.88 MB

english, 1994

35

Simulations of solid-liquid friction at ice-Ih/water interfaces

Louden, Patrick B., Gezelter, J. Daniel

Journal:

The Journal of Chemical Physics

Year:

2013

Language:

english

File:

PDF, 331 KB

english, 2013

36

The role of polarizability in the interfacial thermal conductance at the goldâwater interface

Bhattarai, Hemanta, Newman, Kathie E., Gezelter, J. Daniel

Journal:

The Journal of Chemical Physics

Year:

2020

File:

PDF, 2.98 MB

2020

37

Determination of ionization density of particle tracks with a vidicon

Journal:

Nuclear Instruments and Methods

Year:

1969

Language:

english

File:

PDF, 413 KB

english, 1969

38

The Langevin Hull: Constant Pressure and Temperature Dynamics for Nonperiodic Systems

Vardeman, Charles F., Stocker, Kelsey M., Gezelter, J. Daniel

Journal:

Journal of Chemical Theory and Computation

Year:

2011

Language:

english

File:

PDF, 4.40 MB

english, 2011

39

Size-Dependent Spontaneous Alloying of Au−Ag Nanoparticles

Shibata, Tomohiro, Bunker, Bruce A., Zhang, Zhenyuan, Meisel, Dan, Vardeman, Charles F., Gezelter, J. Daniel

Journal:

Journal of the American Chemical Society

Year:

2002

Language:

english

File:

PDF, 285 KB

english, 2002

40

A gentler approach to RNEMD: Nonisotropic velocity scaling for computing thermal conductivity and shear viscosity

Kuang, Shenyu, Gezelter, J. Daniel

Journal:

The Journal of Chemical Physics

Year:

2010

Language:

english

File:

PDF, 1009 KB

english, 2010

41

Comparing Models for Diffusion in Supercooled Liquids: The Eutectic Composition of the Ag−Cu Alloy †

Vardeman, Charles F., Gezelter, J. Daniel

Journal:

Journal of Physical Chemistry A

Year:

2001

Language:

english

File:

PDF, 96 KB

english, 2001

42

Resonant features in the energy dependence of the rate of ketene isomerization

Gezelter, J. Daniel, Miller, William H.

Journal:

The Journal of Chemical Physics

Year:

1995

Language:

english

File:

PDF, 434 KB

english, 1995

43

Open Source and Open Data Should Be Standard Practices

Gezelter, J. Daniel

Journal:

The Journal of Physical Chemistry Letters

Year:

2015

Language:

english

File:

PDF, 156 KB

english, 2015

44

Simulations of Laser-Induced Glass Formation in Ag-Cu Nanoparticles

Vardeman, C.F., Gezelter, J.D.

Journal:

The Journal of Physical Chemistry C

Year:

2008

Language:

english

File:

PDF, 1.07 MB

english, 2008

45

A Method for Creating Thermal and Angular Momentum Fluxes in Nonperiodic Simulations

Stocker, Kelsey M., Gezelter, J. Daniel

Journal:

Journal of Chemical Theory and Computation

Year:

2014

Language:

english

File:

PDF, 9.15 MB

english, 2014

46

Real space electrostatics for multipoles. II. Comparisons with the Ewald sum

Lamichhane, Madan, Newman, Kathie E., Gezelter, J. Daniel

Journal:

The Journal of Chemical Physics

Year:

2014

Language:

english

File:

PDF, 1.26 MB

english, 2014

47

Simulations of Heat Conduction at Thiolate-Capped Gold Surfaces: The Role of Chain Length and Solvent Penetration

Stocker, Kelsey M., Gezelter, J. Daniel

Journal:

The Journal of Physical Chemistry C

Year:

2013

Language:

english

File:

PDF, 411 KB

english, 2013

48

Rabani, Gezelter, and Berne Reply:

Rabani, Eran, Gezelter, J. Daniel, Berne, B. J.

Journal:

Physical Review Letters

Year:

2000

Language:

english

File:

PDF, 28 KB

english, 2000

49

Nitrile Vibrations as Reporters of Field-Induced Phase Transitions in 4-Cyano-4′-pentylbiphenyl (5CB)

Marr, James M., Gezelter, J. Daniel

Journal:

Journal of Physical Chemistry B

Year:

2014

Language:

english

File:

PDF, 1.79 MB

english, 2014

50

On the structural and transport properties of the soft sticky dipole and related single-point water models

Fennell, Christopher J., Gezelter, J. Daniel

Journal:

The Journal of Chemical Physics

Year:

2004

Language:

english

File:

PDF, 736 KB

english, 2004

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