[ASAP] Operando NMR of NMC811/Graphite Lithium-Ion Batteries: Structure, Dynamics, and Lithium Metal Deposition

		BioNMR > Educational resources > Journal club
[ASAP] Operando NMR of NMC811/Graphite Lithium-Ion Batteries: Structure, Dynamics, and Lithium Metal Deposition

Webservers

NMR processing:

MDD

NMR assignment:

Backbone:

Side-chains:

NOEs:

Structure from NMR restraints:

Ab initio:

Fragment-based:

Rosetta-NMR (Robetta)

Template-based:

GeNMR

I-TASSER

Refinement:

Amber

Structure from chemical shifts:

Fragment-based:

Homology-based:

Torsion angles from chemical shifts:

Preditor

TALOS

Promega- Proline

Secondary structure from chemical shifts:

CSI (via RCI server)

TALOS

MICS caps, β-turns

d2D

PECAN

Flexibility from chemical shifts:

RCI

Interactions from chemical shifts:

HADDOCK

Chemical shifts re-referencing:

NMR model quality:

NOEs, other restraints:

Chemical shifts:

RDCs:

Pseudocontact shifts:

Protein geomtery:

SAVES2 or SAVES4

Quality Control Check

NMR spectrum prediction:

FANDAS

MestReS

V-NMR

Flexibility from structure:

Backbone S2

Methyl S2

B-factor

Molecular dynamics:

Gromacs

Amber

Antechamber

Chemical shifts prediction:

From structure:

Shiftx2

Sparta+

Camshift

CH3shift- Methyl

ArShift- Aromatic

ShiftS

Proshift

PPM

CheShift-2- Cα

From sequence:

Shifty

Camcoil

Poulsen_rc_CS

Disordered proteins:

MAXOCC

Format conversion & validation:

CCPN

From NMR-STAR 3.1

Validate NMR-STAR 3.1

NMR sample preparation:

Protein disorder:

DisMeta

Protein solubility:

Isotope labeling:

Solid-state NMR:

Thread Tools

Search this Thread

Rate Thread

Display Modes

10-04-2020, 05:33 AM

nmrlearner

Senior Member

Join Date: Jan 2005

Posts: 23,777

Points: 193,617, Level: 100

Level up: 0%, 0 Points needed

Activity: 50.7%

Last Achievements

Award-Showcase

NMR Credits: 0

NMR Points: 193,617

Downloads: 0

Uploads: 0

[ASAP] Operando NMR of NMC811/Graphite Lithium-Ion Batteries: Structure, Dynamics, and Lithium Metal Deposition

[ASAP] Operando NMR of NMC811/Graphite Lithium-Ion Batteries: Structure, Dynamics, and Lithium Metal Deposition

Katharina Ma?rker, Chao Xu, and Clare P. Grey

Journal of the American Chemical Society
DOI: 10.1021/jacs.0c06727

Source: Journal of the American Chemical Society

Did you find this post helpful?

Similar Threads
Thread	Thread Starter	Forum	Replies	Last Post
?-NMRMeasurements of Lithium Ion Transportin Thin Films of Pure and Lithium-Salt-Doped Poly(ethylene oxide) ?-NMRMeasurements of Lithium Ion Transportin Thin Films of Pure and Lithium-Salt-Doped Poly(ethylene oxide) Iain McKenzie, Masashi Harada, Robert F. Kiefl, C. D. Philip Levy, W. Andrew MacFarlane, Gerald D. Morris, Shin-Ichi Ogata, Matthew R. Pearson and Jun Sugiyama http://pubs.acs.org/appl/literatum/publisher/achs/journals/content/jacsat/0/jacsat.ahead-of-print/ja503066a/aop/images/medium/ja-2014-03066a_0004.gif Journal of the American Chemical Society DOI: 10.1021/ja503066a http://feeds.feedburner.com/~ff/acs/jacsat?d=yIl2AUoC8zA...	nmrlearner	Journal club	0	05-25-2014 06:31 PM
Lithium-7-NMR spectrum of LiCl (1M) in D2O.gif http://upload.wikimedia.org/wikipedia/commons/thumb/1/1c/Lithium-7-NMR_spectrum_of_LiCl_%281M%29_in_D2O.gif/300px-Lithium-7-NMR_spectrum_of_LiCl_%281M%29_in_D2O.gif Uploaded by user "Stigmatella aurantiaca" on Sat, 14 Dec 2013 10:05:00 GMT Added to category on Sat, 14 Dec 2013 10:06:29 GMT Original image: 512×354 pixel; 6.045 bytes. Licensing : CC-BY-SA Lithium-7-NMR spectrum of LiCl (1M) in D2O.gif More...	nmrlearner	NMR pictures	0	12-14-2013 04:48 PM
[NMR900 blog] NSERC awards $2.3 million for lithium ion battery research NSERC awards $2.3 million for lithium ion battery research Gillian Goward (McMaster) is leading a major collaborative research project in lithium ion batteries which has been awarded a $2.3 million NSERC grant in the Automotive Partnership Canada program. The total value of this four years project is $3.5 million with contributions from industrial partners, GM Canada, Bruker Ltd., and Heka Electronics. Researchers from McMaster include Prof. Gillian Goward, in electrochemistry and magnetic resonance, Prof. Gianluigi Botton, in electron microscopy, and Prof. Bartek Protas, in...	nmrlearner	News from NMR blogs	0	03-23-2012 12:55 AM
Determination of the Lithium Binding Site in Inositol Monophosphatase, the Putative Target for Lithium Therapy, by Magic-Angle-Spinning Solid-State NMR Determination of the Lithium Binding Site in Inositol Monophosphatase, the Putative Target for Lithium Therapy, by Magic-Angle-Spinning Solid-State NMR Anat Haimovich, Uzi Eliav and Amir Goldbourt http://pubs.acs.org/appl/literatum/publisher/achs/journals/content/jacsat/0/jacsat.ahead-of-print/ja211794x/aop/images/medium/ja-2011-11794x_0003.gif Journal of the American Chemical Society DOI: 10.1021/ja211794x http://feeds.feedburner.com/~ff/acs/jacsat?d=yIl2AUoC8zA http://feeds.feedburner.com/~r/acs/jacsat/~4/zT_WbDH70WA	nmrlearner	Journal club	0	03-16-2012 07:24 AM
Mechanistic Studies of the Lithium Enolate of 4-Fluoroacetophenone: Rapid-Injection NMR Study of Enolate Formation, Dynamics, and Aldol Reactivity Mechanistic Studies of the Lithium Enolate of 4-Fluoroacetophenone: Rapid-Injection NMR Study of Enolate Formation, Dynamics, and Aldol Reactivity Kristopher J. Kolonko, Daniel J. Wherritt and Hans J. Reich http://pubs.acs.org/appl/literatum/publisher/achs/journals/content/jacsat/0/jacsat.ahead-of-print/ja207218f/aop/images/medium/ja-2011-07218f_0005.gif Journal of the American Chemical Society DOI: 10.1021/ja207218f http://feeds.feedburner.com/~ff/acs/jacsat?d=yIl2AUoC8zA http://feeds.feedburner.com/~r/acs/jacsat/~4/CiY0RvJQuSc	nmrlearner	Journal club	0	10-04-2011 08:43 AM
Pair Distribution Function Analysis and Solid State NMR Studies of Silicon Electrodes for Lithium Ion Batteries: Understanding the (De)lithiation Mechanisms Pair Distribution Function Analysis and Solid State NMR Studies of Silicon Electrodes for Lithium Ion Batteries: Understanding the (De)lithiation Mechanisms Baris Key, Mathieu Morcrette, Jean-Marie Tarascon and Clare P. Grey http://pubs.acs.org/appl/literatum/publisher/achs/journals/content/jacsat/0/jacsat.ahead-of-print/ja108085d/aop/images/medium/ja-2010-08085d_0006.gif Journal of the American Chemical Society DOI: 10.1021/ja108085d http://feeds.feedburner.com/~ff/acs/jacsat?d=yIl2AUoC8zA http://feeds.feedburner.com/~r/acs/jacsat/~4/WYK7o0vOALs	nmrlearner	Journal club	0	12-21-2010 02:14 AM

« Previous Thread | Next Thread »

Posting Rules
You may not post new threads You may not post replies You may not post attachments You may not edit your posts BB code is On Smilies are On [IMG] code is On HTML code is On Trackbacks are Off Pingbacks are Off Refbacks are Off