[ASAP] Tailorable Indirect to Direct Band-Gap Double Perovskites with Bright White-Light Emission: Decoding Chemical Structure Using Solid-State NMR

		BioNMR > Educational resources > Journal club
[ASAP] Tailorable Indirect to Direct Band-Gap Double Perovskites with Bright White-Light Emission: Decoding Chemical Structure Using Solid-State NMR

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

06-05-2020, 08:56 AM

nmrlearner

Senior Member

Join Date: Jan 2005

Posts: 23,734

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] Tailorable Indirect to Direct Band-Gap Double Perovskites with Bright White-Light Emission: Decoding Chemical Structure Using Solid-State NMR

[ASAP] Tailorable Indirect to Direct Band-Gap Double Perovskites with Bright White-Light Emission: Decoding Chemical Structure Using Solid-State NMR

Abhoy Karmakar†, Guy M. Bernard†, Alkiviathes Meldrum‡, Anton O. Oliynyk§, and Vladimir K. Michaelis*†

Journal of the American Chemical Society
DOI: 10.1021/jacs.0c02198

Source: Journal of the American Chemical Society

Did you find this post helpful?

Similar Threads
Thread	Thread Starter	Forum	Replies	Last Post
[ASAP] Local Structure and Dynamics in Methylammonium, Formamidinium, and Cesium Tin(II) Mixed-Halide Perovskites from 119Sn Solid-State NMR Local Structure and Dynamics in Methylammonium, Formamidinium, and Cesium Tin(II) Mixed-Halide Perovskites from 119Sn Solid-State NMR Dominik J. Kubicki†‡, Daniel Prochowicz§, Elodie Salager??, Aydar Rakhmatullin?, Clare P. Grey‡, Lyndon Emsley#, and Samuel D. Stranks*†? https://pubs.acs.org/na101/home/literatum/publisher/achs/journals/content/jacsat/0/jacsat.ahead-of-print/jacs.0c00647/20200416/images/medium/ja0c00647_0009.gif Journal of the American Chemical Society DOI: 10.1021/jacs.0c00647 http://feeds.feedburner.com/~r/acs/jacsat/~4/XH-n22A6E68	nmrlearner	Journal club	0	04-20-2020 05:10 PM
Sensitivity-Enhanced 207 Pb Solid-State NMR Spectroscopy for the Rapid, Non-Destructive Characterization of Organolead Halide Perovskites #DNPNMR From The DNP-NMR Blog: Sensitivity-Enhanced 207 Pb Solid-State NMR Spectroscopy for the Rapid, Non-Destructive Characterization of Organolead Halide Perovskites #DNPNMR Hanrahan, Michael P., Long Men, Bryan A. Rosales, Javier Vela, and Aaron J. Rossini. “Sensitivity-Enhanced 207 Pb Solid-State NMR Spectroscopy for the Rapid, Non-Destructive Characterization of Organolead Halide Perovskites.” Chemistry of Materials, October 4, 2018. https://doi.org/10.1021/acs.chemmater.8b01899.	nmrlearner	News from NMR blogs	0	11-25-2018 06:02 AM
[ASAP] X-ray Emission Spectroscopy as an in Situ Diagnostic Tool for X-ray Crystallography of Metalloproteins Using an X-ray Free-Electron Laser X-ray Emission Spectroscopy as an in Situ Diagnostic Tool for X-ray Crystallography of Metalloproteins Using an X-ray Free-Electron Laser https://pubs.acs.org/appl/literatum/publisher/achs/journals/content/bichaw/0/bichaw.ahead-of-print/acs.biochem.8b00325/20180628/images/medium/bi-2018-00325f_0007.gif Biochemistry DOI: 10.1021/acs.biochem.8b00325 http://feeds.feedburner.com/~ff/acs/bichaw?d=yIl2AUoC8zA http://feeds.feedburner.com/~r/acs/bichaw/~4/h0rNnSSvyKY More...	nmrlearner	Journal club	0	06-29-2018 08:31 AM
[ASAP] The Chemical Structure of Carbon Nanothreads Analyzed by Advanced Solid-State NMR The Chemical Structure of Carbon Nanothreads Analyzed by Advanced Solid-State NMR Pu Duan, Xiang Li, Tao Wang, Bo Chen, Stephen J. Juhl, Daniel Koeplinger, Vincent H. Crespi, John V. Badding, Klaus Schmidt-Rohr https://pubs.acs.org/appl/literatum/publisher/achs/journals/content/jacsat/0/jacsat.ahead-of-print/jacs.8b03733/20180608/images/medium/ja-2018-037336_0012.gif Journal of the American Chemical Society DOI: 10.1021/jacs.8b03733 http://feeds.feedburner.com/~ff/acs/jacsat?d=yIl2AUoC8zA http://feeds.feedburner.com/~r/acs/jacsat/~4/Kz-Mqrv4K8I	nmrlearner	Journal club	0	06-11-2018 07:38 PM
[ASAP] Phase Segregation in Potassium-Doped Lead Halide Perovskites from 39K Solid-State NMR at 21.1 T Phase Segregation in Potassium-Doped Lead Halide Perovskites from 39K Solid-State NMR at 21.1 T Dominik J. Kubicki, Daniel Prochowicz, Albert Hofstetter, Shaik M. Zakeeruddin, Michael Grätzel, Lyndon Emsley https://pubs.acs.org/appl/literatum/publisher/achs/journals/content/jacsat/0/jacsat.ahead-of-print/jacs.8b03191/20180531/images/medium/ja-2018-03191d_0005.gif Journal of the American Chemical Society DOI: 10.1021/jacs.8b03191 http://feeds.feedburner.com/~ff/acs/jacsat?d=yIl2AUoC8zA http://feeds.feedburner.com/~r/acs/jacsat/~4/BBIRX6v6V1A	nmrlearner	Journal club	0	06-02-2018 12:51 AM
[NMR paper] When Fluorescent Proteins Meet White Light-Emitting Diodes When Fluorescent Proteins Meet White Light-Emitting Diodes Over the last decades, fluorescent proteins (FPs) have been extensively employed for imaging and tracing in cell-biology and medicine. However, their application for lighting devices like light-emitting diodes (LEDs) and lasers has recently started. The interest of FPs lies on their good photoluminescence features (high emission efficiency with a narrow spectrum and a high photon flux saturation), good photostability, low-cost production via bacteria, and eco-friendly recycling. The low stability at high temperatures as well as...	nmrlearner	Journal club	0	12-31-2017 10:41 AM
Dual-band Selective Double Cross Polarization for Heteronuclear Polarization Transfer between Dilute Spins in Solid-State MAS NMR Dual-band Selective Double Cross Polarization for Heteronuclear Polarization Transfer between Dilute Spins in Solid-State MAS NMR Publication year: 2012 Source:Journal of Magnetic Resonance</br> Zhengfeng Zhang, Yimin Miao, Xiaoli Liu, Jun Yang, Conggang Li, Feng Deng, Riqiang Fu</br> A sinusoidal modulation scheme is described for selective heteronuclear polarization transfer between two dilute spins in double cross polarization magic-angle-spinning nuclear magnetic resonance spectroscopy. During the second N->C cross polarization, the 13C RF amplitude is...	nmrlearner	Journal club	0	03-09-2012 09:16 AM
Dual-band Selective Double Cross Polarization for Heteronuclear Polarization Transfer between Dilute Spins in Solid-State MAS NMR Dual-band Selective Double Cross Polarization for Heteronuclear Polarization Transfer between Dilute Spins in Solid-State MAS NMR Publication year: 2012 Source: Journal of Magnetic Resonance, Available online 5 March 2012</br> ZhengfengZhang, YiminMiao, XiaoliLiu, JunYang, Conggang*Li, ...</br> A sinusoidal modulation scheme is described for selective heteronuclear polarization transfer between two dilute spins in double cross polarization magic-angle-spinning nuclear magnetic resonance spectroscopy. During the second N->C cross polarization, theC RF amplitude is modulated...	nmrlearner	Journal club	0	03-06-2012 06:04 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