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[ASAP] Calculation of Anharmonic IR and Raman Intensities for Periodic Systems from DFT Calculations: Implementation and Validation

Journal of Chemical Theory and Computation
DOI: 10.1021/acs.jctc.9b01061




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[ASAP] Nuclear Quantum Effects from the Analysis of Smoothed Trajectories: Pilot Study for Water

Journal of Chemical Theory and Computation
DOI: 10.1021/acs.jctc.9b00703




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[ASAP] Polarizable Molecular Dynamics Simulations of Two <italic toggle="yes">c-kit</italic> Oncogene Promoter G-Quadruplexes: Effect of Primary and Secondary Structure on Loop and Ion Sampling

Journal of Chemical Theory and Computation
DOI: 10.1021/acs.jctc.0c00191




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[ASAP] Benchmarking Correlated Methods for Frequency-Dependent Polarizabilities: Aromatic Molecules with the CC3, CCSD, CC2, SOPPA, SOPPA(CC2), and SOPPA(CCSD) Methods

Journal of Chemical Theory and Computation
DOI: 10.1021/acs.jctc.9b01300




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[ASAP] Efficient Analytic Second Derivative of Electrostatic Embedding QM/MM Energy: Normal Mode Analysis of Plant Cryptochrome

Journal of Chemical Theory and Computation
DOI: 10.1021/acs.jctc.9b01145




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[ASAP] Generalized Form for Finite-Size Corrections in Mutual Diffusion Coefficients of Multicomponent Mixtures Obtained from Equilibrium Molecular Dynamics Simulation

Journal of Chemical Theory and Computation
DOI: 10.1021/acs.jctc.0c00268




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'New drug combo shows promise against Covid'

A two-week course of an antiviral therapy, started within 7 days of experiencing Covid-19 symptoms, may improve clinical recovery of patients and reduce their hospital stay duration, according to the first randomised trial of this triple drug combination. The treatment combination, according to the scientists, also appeared safe and well tolerated by patients.




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I am healthy, not suffering from any disease: Shah

Union home minister Amit Shah on Saturday said he is "totally healthy" and not suffering from any disease. Shah said rumours about his health conditions have been spread through social media. "I am totally healthy and I am not suffering from any disease," he said in the statement in Hindi which was posted on his Twitter handle.




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Atomic fluorescence spectrometry for ultrasensitive determination of bismuth based on hydride generation – the role of excitation source, interference filter and flame atomizers

J. Anal. At. Spectrom., 2020, Advance Article
DOI: 10.1039/D0JA00043D, Paper
Barbora Štádlerová, Marta Kolrosová, Jiří Dědina, Stanislav Musil
A method of highly sensitive bismuth determination by hydride generation coupled with in-house assembled non-dispersive atomic fluorescence spectrometry was developed.
To cite this article before page numbers are assigned, use the DOI form of citation above.
The content of this RSS Feed (c) The Royal Society of Chemistry




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‘Blind time’ – current limitations on laser ablation multi-collector inductively coupled plasma mass spectrometry (LA-MC-ICP-MS) for ultra-transient signal isotope ratio analysis and application to individual sub-micron sized uranium particles

J. Anal. At. Spectrom., 2020, Advance Article
DOI: 10.1039/D0JA00066C, Paper
Grant Craig, Matthew S. A. Horstwood, Helen J. Reid, Barry L. Sharp
Gaps in acquisition between integration times for MC-ICP-MS can introduce isotope ratio bias with a mixed detector array.
To cite this article before page numbers are assigned, use the DOI form of citation above.
The content of this RSS Feed (c) The Royal Society of Chemistry




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Inductively coupled plasma mass spectrometry coupled to cation exchange chromatography for the determination of trace nickel in alkaline electrolyte

J. Anal. At. Spectrom., 2020, Advance Article
DOI: 10.1039/D0JA00071J, Technical Note
Lukas Miner, Diane Beauchemin
Cone corrosion by alkaline solutions with flow injection is prevented using cation-exchange chromatography coupled to inductively coupled plasma mass spectrometry.
To cite this article before page numbers are assigned, use the DOI form of citation above.
The content of this RSS Feed (c) The Royal Society of Chemistry




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Development of a method for the direct determination of fluorine in solid samples using electrothermal vaporization coupled to inductively coupled plasma optical emission spectrometry

J. Anal. At. Spectrom., 2020, Advance Article
DOI: 10.1039/D0JA00079E, Technical Note
Patricia Maung, Diane Beauchemin
ETV-ICPOES in atomic emission mode allows the direct determination of as low as 30 μg kg−1 fluorine in solid samples.
To cite this article before page numbers are assigned, use the DOI form of citation above.
The content of this RSS Feed (c) The Royal Society of Chemistry




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Portable Photochemical Vapor Generation-Microwave Plasma Optical Emission Spectrometer

J. Anal. At. Spectrom., 2020, Accepted Manuscript
DOI: 10.1039/D0JA00104J, Technical Note
Yujia Deng, Wen Zeng, Xiaoming Jiang, Xiandeng Hou
A low power microwave plasma torch as an excitation source was combined with photochemical vapor generation (PVG) and a miniaturized charge-coupled device to construct a portable optical emission spectrometer. The...
The content of this RSS Feed (c) The Royal Society of Chemistry




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Secondary Ion Mass Spectrometry for Biological Applications

J. Anal. At. Spectrom., 2020, Advance Article
DOI: 10.1039/D0JA90020F, Editorial
Dirk Schaumlöffel
Dirk Schaumlöffel introduces the JAAS themed collection on Secondary Ion Mass Spectrometry for Biological Applications.
To cite this article before page numbers are assigned, use the DOI form of citation above.
The content of this RSS Feed (c) The Royal Society of Chemistry




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Ultra-sensitive determination of antimony valence by solution cathode glow discharge optical emission spectrometry coupled with hydride generation

J. Anal. At. Spectrom., 2020, Advance Article
DOI: 10.1039/D0JA00009D, Paper
Mingyue Zhao, Xiaoxu Peng, Bingcheng Yang, Zheng Wang
An ultra-sensitive solution cathode glow discharge-optical emission spectrometry (SCGD-OES) method coupled with hydride generation (HG) for the determination of antimony valence is described.
To cite this article before page numbers are assigned, use the DOI form of citation above.
The content of this RSS Feed (c) The Royal Society of Chemistry




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A total consumption (up to 75 μL min−1) infrared-heated sample introduction system for inductively coupled plasma optical emission spectrometry

J. Anal. At. Spectrom., 2020, Advance Article
DOI: 10.1039/D0JA00068J, Paper
Ahmed Al Hejami, Mirah J. Burgener, John Burgener, Diane Beauchemin
A compact infrared-heated sample introduction system provides similar analytical performance with higher robustness and faster washout than commercially available nebulization systems.
To cite this article before page numbers are assigned, use the DOI form of citation above.
The content of this RSS Feed (c) The Royal Society of Chemistry




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Atomic spectrometry update: review of advances in atomic spectrometry and related techniques

J. Anal. At. Spectrom., 2020, Advance Article
DOI: 10.1039/D0JA90015J, Atomic Spectrometry Update
E. Hywel Evans, Jorge Pisonero, Clare M. M. Smith, Rex N. Taylor
This review covers advances in atomic spectrometric techniques, including atomic emission, absorption, fluorescence and mass spectrometry. Material on speciation and coupled techniques is not covered as this is included in a separate ASU review.
To cite this article before page numbers are assigned, use the DOI form of citation above.
The content of this RSS Feed (c) The Royal Society of Chemistry




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High-resolution atomic structure of rubidium compounds in L X-ray spectral lines: a promising explores for chemical analysis

J. Anal. At. Spectrom., 2020, Accepted Manuscript
DOI: 10.1039/D0JA00063A, Paper
Harpreet Singh Kainth
The outcomes of X-ray fluorescence (XRF) analysis have been made an immense influence on the chemical profiles in various materials used for industrial and medical purposes. In the beginning of...
The content of this RSS Feed (c) The Royal Society of Chemistry




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Evidence for Photochemical Synthesis of Fluoromethane

J. Anal. At. Spectrom., 2020, Accepted Manuscript
DOI: 10.1039/D0JA00108B, Communication
Ralph E Sturgeon, Enea Pagliano
Photochemical generation of volatile fluoromethane in a dilute acetic acid medium is demonstrated. Radical halogen atom transfer (XAT) from an intermediate Cu-F transition metal fluorocomplex to abundant •CH3 generated by...
The content of this RSS Feed (c) The Royal Society of Chemistry




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Extractive separation of rare earth elements and their determination by inductively coupled plasma optical emission spectrometry in geological samples

J. Anal. At. Spectrom., 2020, Accepted Manuscript
DOI: 10.1039/D0JA00190B, Paper
Susanta Kumar Pradhan, Balram Ambade
A simple, rapid and effective solvent extraction separation of rare earth elements (REEs) has been developed for their determination in geological samples such as rock, soil and core samples by...
The content of this RSS Feed (c) The Royal Society of Chemistry




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Top 10 Bible Studies from James for Fall 2019

This fall’s top ten list cover a variety of bible studies on James. Each curriculum gives you resources to lead a group study, but is also perfect as your own personal study.




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33-year-old Olympic medal winner dies from cancer




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8 Business Titans Reveal the Best Social Media Tactics to Promote Your Company

If you are not promoting your business on social media, you are asleep at the wheel. Here is what eight social media masters and Advisors in The Oracles told us about the channels and tactics that impact their businesses most.

complete article




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Law Enforcement RSS Feeds from Police One

If you hate missing out on the latest news from PoliceOne, are having a hard time managing the deluge of information you receive from our newsletters, or simply want a more convenient way to manage and control your online news and information, RSS feeds may be the answer.

complete article




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Feedly is developing an AI tool to help its users prioritize articles from RSS feeds

Feedly, a popular RSS feed reader with millions of users worldwide, recently announced the creation of a new AI research assistant named Leo. Their goal with Leo is to create an AI with a set of skills that will enable it to better prioritize articles from news feeds.

complete article




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Mailbrew launches to create auto email newsletters from Reddit, Twitter, YouTube, RSS feeds

A new service called Mailbrew is live that lets you created automated email newsletters. You can set them up from multiple sources including Twitter, Reddit, YouTube, RSS feeds, and more.

Mailbrew aims to save you time by rounding up the news and updates you care about from a variety of sources and popping it in a daily, weekly, or monthly automated email newsletter.

To start, you can create custom brews, choose from pre-made ones, or make use of both. You even get to choose the layout you’d like to use for the newsletters.

complete article




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Smart RSS Reader is a feed reader extension for Firefox and Chrome

Web based feed readers are kind of a pain to use. They often implement changes that you do not want, while taking away features that you like.  Local readers are much better when it comes to this, because you can revert to an older version in case of adverse changes.

complete article




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Feedly is developing an AI tool to help its users prioritize articles from RSS feeds

Feedly, a popular RSS feed reader with millions of users worldwide, recently announced the creation of a new AI research assistant named Leo. Their goal with Leo is to create an AI with a set of skills that will enable it to better prioritize articles from news feeds.




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Stop Travel Memories From Appearing in Your Social Media Feeds

Our stress levels are at an all-time high right now, which means our attentiveness to our own self-care should be, too—especially those of us with wanderlust. Traveling from the living room to the kitchen and back is no one’s ideal of a vacation, yet here we are. On top of that, our social media platforms seem determined to remind us of better days: Hey, look where you were a year ago today! blares Facebook, serving up a photo of a gorgeous beach or other getaway spot much more alluring than the permanent butt-groove you have formed in your couch.

For many of us, looking back on our travels past is not doing us much good at the moment. Luckily, there are a few methods to keep them from showing up in your social media feeds.




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Smart RSS Reader is a feed reader extension for Firefox and Chrome

Web based feed readers are kind of a pain to use. They often implement changes that you don't want, while taking away features that you like.  Local readers are much better when it comes to this, because you can revert to an older version in case of adverse changes.

Smart RSS Reader is a feed reader extension for Firefox and Chrome that I have been using for a week; I am quite impressed by it so far.

Install the add-on and click its toolbar icon to open a new tab with the extension's RSS reader. It has three panes, each of which has a toolbar at the top. The left pane is the feeds pane and lists all RSS feeds that you're subscribed too. Selecting a feed displays the title of the articles published by the site in the center pane. It also displays the author's name and the date when the article went live.




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I am healthy, not suffering from any disease, says Amit Shah

Union home minister Amit Shah on Saturday said he is "totally healthy" and not suffering from any disease. Shah said rumours about his health conditions have been spread through social media. "I am totally healthy and I am not suffering from any disease," he said in the statement in Hindi which was posted on his Twitter handle.




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Two Indians brought back from Gulf test Covid positive in Kerala

Two Indians, who were among the 363 nationals brought back to Kerala from the Gulf, have tested positive for Covid-19, chief minister Pinarayi Vijayan said on Saturday. With this, the total number of active cases has climbed to 17 in the state. The patients have been admitted to hospitals in Kozhikode and Kochi.




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What Fred Warner learned from 49ers' tough Super Bowl loss vs. Chiefs

Fred Warner has watched Super Bowl LIV a few times, and he knows what went wrong against the Chiefs.




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What 49ers' Laken Tomlinson learned from Joe Staley on, off the field

Joe Staley left 49ers guard Laken Tomlinson with some valuable lessons.




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NFL Network's Steve Smith Sr.: 'Beware' of creative tricks from New England Patriots head coach Bill Belichick in 2020

NFL Network's Steve Smith Sr. warns to "beware' of creative tricks from New England Patriots head coach Bill Belichick in 2020.




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Screening metal-free photocatalysts from isomorphic covalent organic frameworks for the C-3 functionalization of indoles

J. Mater. Chem. A, 2020, 8,8706-8715
DOI: 10.1039/D0TA02164D, Paper
Ziping Li, Songjie Han, Chunzhi Li, Pengpeng Shao, Hong Xia, He Li, Xiong Chen, Xiao Feng, Xiaoming Liu
An excellent framework photocatalyst was screened from a series of isomorphic COFs. The photocatalytic properties of C-3 functionalization of indoles by COF-based photocatalysts were first reported.
The content of this RSS Feed (c) The Royal Society of Chemistry




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Hydrogen generation from toxic formaldehyde catalyzed by low-cost Pd–Sn alloys driven by visible light

J. Mater. Chem. A, 2020, Advance Article
DOI: 10.1039/D0TA02833A, Paper
Hongxia Liu, Meng Wang, Jiantai Ma, Gongxuan Lu
New high active low-cost Pd-Sn alloy catalyst for hydrogen evolution from toxic formaldehyde driven by visible light was developed via alloying of Pd with abundance element Sn.
To cite this article before page numbers are assigned, use the DOI form of citation above.
The content of this RSS Feed (c) The Royal Society of Chemistry




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Recent progress in carbonyl-based organic polymers as promising electrode materials for lithium-ion batteries (LIBs)

J. Mater. Chem. A, 2020, Advance Article
DOI: 10.1039/D0TA03321A, Review Article
Hao Wang, Chang-Jiang Yao, Hai-Jing Nie, Ke-Zhi Wang, Yu-Wu Zhong, Pengwan Chen, Shilin Mei, Qichun Zhang
Lithium-ion batteries (LIBs) have been demonstrated as one of the most promising energy storage devices for applications in electric vehicles, smart grids, large-scale energy storage systems, and portable electronics.
To cite this article before page numbers are assigned, use the DOI form of citation above.
The content of this RSS Feed (c) The Royal Society of Chemistry




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Highly efficient removal of uranium from highly acidic media achieved on a phosphine oxide and amino functionalized superparamagnetic composite polymer adsorbent

J. Mater. Chem. A, 2020, Accepted Manuscript
DOI: 10.1039/D0TA01633K, Paper
Shiao Zhang, Dingzhong Yuan, Qinghua Zhang, Yun Wang, Yan Liu, Jizhou Zhao, Bibo Chen
It is very necessary to develop the magnetic adsorbents for the efficient extraction of uranium from highly acidic media. In this work, a novel magnetic adsorbent Fe3O4/P (DMAA-DMP) functionalized with...
The content of this RSS Feed (c) The Royal Society of Chemistry




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Dihydrazone-based Dynamic Covalent Epoxy Networks with High Creep Resistance, Controlled Degradability, and Intrinsic Antibacteria from Bioresources

J. Mater. Chem. A, 2020, Accepted Manuscript
DOI: 10.1039/D0TA01419B, Paper
Xiwei Xu, Songqi Ma, Sheng Wang, Jiahui Wu, Qiong Li, na lu, yanlin liu, Jintao Yang, Jie Feng, Jin Zhu
Covalent adaptable networks (CANs) provide a promising approach to the recycle issue of thermosets due to their dynamic cross-linked networks. However, CANs are susceptible to creep at relatively low temperatures,...
The content of this RSS Feed (c) The Royal Society of Chemistry




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Bimetallic-MOF Catalyst for Efficient CO2 Photoreduction from Simulated Flue Gas to Value-added Formate

J. Mater. Chem. A, 2020, Accepted Manuscript
DOI: 10.1039/D0TA00205D, Paper
Shao-hong Guo, Xiang-Juan Qi, Hui-Min Zhou, Jie Zhou, Xiao-Hui Wang, Man Dong, Xue Zhao, Chun-Yi Sun, Xinlong Wang, Zhong-Min Su
Direct CO2 conversion from flue gas into high-value products is of great significance not only in relieving environmental burden but alleviating energy crisis by a low-cost and saving-energy avenue, yet...
The content of this RSS Feed (c) The Royal Society of Chemistry




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Now Available: Concerts from the Library of Congress

 

You can get tickets for any 2020 event that is part of Concerts from the Library of Congress.

PLEASE NOTE: All films, talks and pre-concert events this year are general admission with no ticket required, unless otherwise indicated. You can still register for reminders and updates about those events, but seating will be first-come, first-served.

Click here for more information.

Request ADA accommodations five business days in advance at (202) 707-6362 or ADA@loc.gov.




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CVC Capital set to buy into Cancer chain HCG, to be co-promoter

Singapore's Temasek holds a 9.4% stake in the widely held company, while Indgrowth Capital owns 1.2%. Public shareholding is 76.1%, as per latest regulatory disclosures.




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Missa Charles Darwin / Gregory W. Brown ; texts from Charles Darwin

MEDIA PhonCD B8128 mis




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The Andrée expedition: From the diary of Virginia Woolf / Dominick Argento

MEDIA PhonCD Ar37 song




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'From noon to starry night' / Baker

MEDIA PhonCD B171 insmu




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Music from SEAMUS.

MEDIA PhonCD M973 sea26




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[ASAP] Thiol Activation toward Selective Thiolation of Aromatic C–H Bond

Organic Letters
DOI: 10.1021/acs.orglett.0c01050




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[ASAP] A One-Pot Iodo-Cyclization/Transition Metal-Catalyzed Cross-Coupling Sequence: Synthesis of Substituted Oxazolidin-2-ones from <italic toggle="yes">N</italic>-Boc-allylamines

Organic Letters
DOI: 10.1021/acs.orglett.0c01114




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[ASAP] Photochemical Oxidation Specific to Distorted Aromatic Amines Providing <italic toggle="yes">ortho</italic>-Diketones

Organic Letters
DOI: 10.1021/acs.orglett.0c01190