ca [ASAP] Further Optimization and Validation of the Classical Drude Polarizable Protein Force Field By feedproxy.google.com Published On :: Mon, 27 Apr 2020 04:00:00 GMT Journal of Chemical Theory and ComputationDOI: 10.1021/acs.jctc.0c00057 Full Article
ca [ASAP] Scalable Electron Correlation Methods. 7. Local Open-Shell Coupled-Cluster Methods Using Pair Natural Orbitals: PNO-RCCSD and PNO-UCCSD By feedproxy.google.com Published On :: Mon, 27 Apr 2020 04:00:00 GMT Journal of Chemical Theory and ComputationDOI: 10.1021/acs.jctc.0c00192 Full Article
ca [ASAP] Calculation of Anharmonic IR and Raman Intensities for Periodic Systems from DFT Calculations: Implementation and Validation By feedproxy.google.com Published On :: Tue, 28 Apr 2020 04:00:00 GMT Journal of Chemical Theory and ComputationDOI: 10.1021/acs.jctc.9b01061 Full Article
ca [ASAP] Predicting Ligand-Dissociation Energies of 3d Coordination Complexes with Auxiliary-Field Quantum Monte Carlo By feedproxy.google.com Published On :: Wed, 29 Apr 2020 04:00:00 GMT Journal of Chemical Theory and ComputationDOI: 10.1021/acs.jctc.0c00070 Full Article
ca [ASAP] Comparison of Spin-Flip TDDFT-Based Conical Intersection Approaches with XMS-CASPT2 By feedproxy.google.com Published On :: Mon, 04 May 2020 04:00:00 GMT Journal of Chemical Theory and ComputationDOI: 10.1021/acs.jctc.9b00917 Full Article
ca [ASAP] Implementation of Coherent Switching with Decay of Mixing into the SHARC Program By feedproxy.google.com Published On :: Mon, 04 May 2020 04:00:00 GMT Journal of Chemical Theory and ComputationDOI: 10.1021/acs.jctc.0c00112 Full Article
ca [ASAP] Direct Unconstrained Variable-Metric Localization of One-Electron Orbitals By feedproxy.google.com Published On :: Tue, 05 May 2020 04:00:00 GMT Journal of Chemical Theory and ComputationDOI: 10.1021/acs.jctc.9b01286 Full Article
ca Fake: Amit Shah doesn't have ‘bone cancer’ By timesofindia.indiatimes.com Published On :: Sat, 09 May 2020 11:18:01 GMT A tweet attributed to Home Minister Amit Shah’s verified Twitter handle, in which he says that he has bone cancer is being circulated across social media platforms. In the tweet, Shah can be seen imploring Muslims to pray for his good health during Ramzan. Full Article
ca Live: Covid testing capacity scaled up to 95,000 per day, says Centre By timesofindia.indiatimes.com Published On :: Fri, 08 May 2020 21:27:08 GMT India’s Covid-19 count is nearing 60,000 mark with 59,662 cases after new cases topped 3,000 for the third consecutive day. The overall death toll too was just short of 2,000 at 1,981. Overall, 3,294 fresh cases were reported from states in past 24-hour. Stay here for all live updates Full Article
ca The high-accuracy prediction of carbon content in semi-coke by laser-induced breakdown spectroscopy By feeds.rsc.org Published On :: J. Anal. At. Spectrom., 2020, Advance ArticleDOI: 10.1039/C9JA00443B, PaperXiangjun Xu, Angze Li, Xianshuang Wang, Chunjie Ding, Suling Qiu, Yage He, Tianqi Lu, Feng He, Bingsuo Zou, Ruibin LiuLIBS technology is used in the realization process of semi-coke detection.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 Full Article
ca How much aqueous sample can an inductively coupled plasma withstand? By feeds.rsc.org Published On :: J. Anal. At. Spectrom., 2020, Accepted ManuscriptDOI: 10.1039/D0JA00070A, Technical NoteAhmed Al Hejami, John A. Burgener, Mirah Burgener, Diane BeaucheminDuring this study, a compact infrared-heated sample introduction system at 200°C, consisting of a modified cyclonic spray chamber with a ceramic rod heater within a baffle in its centre and...The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
ca ‘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 By feeds.rsc.org Published On :: J. Anal. At. Spectrom., 2020, Advance ArticleDOI: 10.1039/D0JA00066C, PaperGrant Craig, Matthew S. A. Horstwood, Helen J. Reid, Barry L. SharpGaps 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 Full Article
ca Re-examination of complexation behaviors of V(V) and V(IV): experimental investigation and theoretical simulation By feeds.rsc.org Published On :: J. Anal. At. Spectrom., 2020, Advance ArticleDOI: 10.1039/D0JA00018C, PaperHong-Yi Li, Dan-Qing Li, Yang Yang, Xie Zhang, Jiang Diao, Bing XieThis work has corrected the assumed over-assessed stability constants and tensioned stereo structures of V–EDTA complexes.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 Full Article
ca Inductively coupled plasma mass spectrometry coupled to cation exchange chromatography for the determination of trace nickel in alkaline electrolyte By feeds.rsc.org Published On :: J. Anal. At. Spectrom., 2020, Advance ArticleDOI: 10.1039/D0JA00071J, Technical NoteLukas Miner, Diane BeaucheminCone 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 Full Article
ca Development of a method for the direct determination of fluorine in solid samples using electrothermal vaporization coupled to inductively coupled plasma optical emission spectrometry By feeds.rsc.org Published On :: J. Anal. At. Spectrom., 2020, Advance ArticleDOI: 10.1039/D0JA00079E, Technical NotePatricia Maung, Diane BeaucheminETV-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 Full Article
ca Laser-induced breakdown spectroscopy (LIBS) spectra interpretation and characterization using parallel factor analysis (PARAFAC): a new procedure for data and spectral interference processing fostering the waste electrical and electronic equipment (WEEE) By feeds.rsc.org Published On :: J. Anal. At. Spectrom., 2020, Advance ArticleDOI: 10.1039/D0JA00026D, PaperJeyne Pricylla Castro, Edenir Rodrigues Pereira-Filho, Rasmus BroFor the first time, PARAFAC was used to interpret and characterize LIBS spectra, providing the pure spectra, the signal profile and relative concentration of base and noble elements present on a printed circuit board from the hard disk.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 Full Article
ca Interaction of nanoparticle properties and X-ray analytical techniques By feeds.rsc.org Published On :: J. Anal. At. Spectrom., 2020, Advance ArticleDOI: 10.1039/D0JA00049C, PaperRainer Unterumsberger, Philipp Hönicke, Yves Kayser, Beatrix Pollakowski-Herrmann, Saeed Gholhaki, Quanmin Guo, Richard E. Palmer, Burkhard BeckhoffIn this work, Pt–Ti core–shell nanoparticles were characterized using reference-free X-ray fluorescence analysis and used for the investigation of the modification of the X-Ray Standing Wave (XSW) field intensity with increasing NP surface coverage.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 Full Article
ca Portable Photochemical Vapor Generation-Microwave Plasma Optical Emission Spectrometer By feeds.rsc.org Published On :: J. Anal. At. Spectrom., 2020, Accepted ManuscriptDOI: 10.1039/D0JA00104J, Technical NoteYujia Deng, Wen Zeng, Xiaoming Jiang, Xiandeng HouA 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 Full Article
ca Calibration-free quantitative analysis of D/H isotopes with fs-laser filament By feeds.rsc.org Published On :: J. Anal. At. Spectrom., 2020, Accepted ManuscriptDOI: 10.1039/D0JA00062K, PaperGenggeng Li, Huaming Hou, Pengxu Ran, Yunlong Zhao, Zhengye ZhongThe analytical characteristics of D/H isotopes with fs-laser filament are investigated via analyzing a set of D-enriched water samples with D concentrations from 0.5 to 20%. The filament emission spectra...The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
ca Secondary Ion Mass Spectrometry for Biological Applications By feeds.rsc.org Published On :: J. Anal. At. Spectrom., 2020, Advance ArticleDOI: 10.1039/D0JA90020F, EditorialDirk SchaumlöffelDirk 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 Full Article
ca Ultra-sensitive determination of antimony valence by solution cathode glow discharge optical emission spectrometry coupled with hydride generation By feeds.rsc.org Published On :: J. Anal. At. Spectrom., 2020, Advance ArticleDOI: 10.1039/D0JA00009D, PaperMingyue Zhao, Xiaoxu Peng, Bingcheng Yang, Zheng WangAn 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 Full Article
ca High performance method for the accurate and precise determination of silicon isotopic compositions in bulk silicate rock samples using laser ablation MC-ICP-MS By feeds.rsc.org Published On :: J. Anal. At. Spectrom., 2020, Accepted ManuscriptDOI: 10.1039/D0JA00036A, PaperChenxi Zhang, He Zhao, Wen Zhang, Tao Luo, Ming Li, Keqing Zong, Yongsheng Liu, Zhaochu HuMC-ICP-MS has become one of the most powerful analytical methods for Si isotopes in bulk liquid and solid samples in the past decade. Laser ablation provides direct sampling of solid...The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
ca A total consumption (up to 75 μL min−1) infrared-heated sample introduction system for inductively coupled plasma optical emission spectrometry By feeds.rsc.org Published On :: J. Anal. At. Spectrom., 2020, Advance ArticleDOI: 10.1039/D0JA00068J, PaperAhmed Al Hejami, Mirah J. Burgener, John Burgener, Diane BeaucheminA 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 Full Article
ca High-resolution atomic structure of rubidium compounds in L X-ray spectral lines: a promising explores for chemical analysis By feeds.rsc.org Published On :: J. Anal. At. Spectrom., 2020, Accepted ManuscriptDOI: 10.1039/D0JA00063A, PaperHarpreet Singh KainthThe 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 Full Article
ca Evidence for Photochemical Synthesis of Fluoromethane By feeds.rsc.org Published On :: J. Anal. At. Spectrom., 2020, Accepted ManuscriptDOI: 10.1039/D0JA00108B, CommunicationRalph E Sturgeon, Enea PaglianoPhotochemical 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 Full Article
ca Zirconium stable isotope analysis of zircon by MC-ICP-MS: Methods and application to evaluating intra-crystalline zonation in a zircon megacryst By feeds.rsc.org Published On :: J. Anal. At. Spectrom., 2020, Accepted ManuscriptDOI: 10.1039/C9JA00315K, Paper Open Access   This article is licensed under a Creative Commons Attribution-NonCommercial 3.0 Unported Licence.Hannah G. D. Tompkins, Lisa Joanne Zieman, Mauricio Ibañez-Mejia, François L.H. TissotZirconium (Zr) plays a key role in the development of phases like zircon (ZrSiO4) and baddeleyite (ZrO2) in magmatic systems. These minerals are crucial for the study of geologic time...The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
ca Feasibility study on application of Laser Induced Breakdown Spectroscopy for detection & identification of failed fuel pin and sodium-water reaction in Fast Reactors By feeds.rsc.org Published On :: J. Anal. At. Spectrom., 2020, Accepted ManuscriptDOI: 10.1039/D0JA00077A, PaperNamitha J., Ujjwal Kumar Maity, Thangaraj Selvalakshmi, Manoravi Periasamy, Ashok Kumar G. V. S., Joseph M, Nagarajan SivaramanIn a fast reactor, during the analysis of core cover gas, the presence of gaseous fission products, namely, Kr and Xe or presence of He (in case of He bonded...The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
ca Extractive separation of rare earth elements and their determination by inductively coupled plasma optical emission spectrometry in geological samples By feeds.rsc.org Published On :: J. Anal. At. Spectrom., 2020, Accepted ManuscriptDOI: 10.1039/D0JA00190B, PaperSusanta Kumar Pradhan, Balram AmbadeA 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 Full Article
ca 33-year-old Olympic medal winner dies from cancer By timesofindia.indiatimes.com Published On :: Fri, 04 Mar 2016 08:25:43 IST Full Article
ca College Campuses: A Hot Spot For Social Media Influencers By www.rss-specifications.com Published On :: Fri, 9 Aug 2019 14:19:32 -0400 It is a heady formula. With brands across the globe spending nearly $27 billion on social media marketing, an expenditure estimated to go up 37% by 2020 to reach $37 billion, and 45% of the worlds population actively engaged on social media, one unlikely sector has found a lucrative and free marketing source – college students. Several universities across the country have begun using so-called student ambassadors or influencers to market their brand on Instagram, Twitter and YouTube. According to a 2018 study by Pricewaterhouse Coopers, social media is the most influential marketing source for potential buyers. Over 70% of social media users hit the college sweet spot: individuals between the ages of 18-29. complete article Full Article
ca Twitter Provides Tips for Halloween Campaigns By www.rss-specifications.com Published On :: Mon, 7 Oct 2019 18:04:23 -0400 Halloween is coming, and that means that brands are looking at ways they can tap into the rising Halloween conversation, and maximize their exposure by latching onto trending hashtags. And this week, Twitter has provided some notes to help you maximize your Halloween tie-ins on the platform - and within them, there are a couple of hidden gems of information, which likely apply to your tweet strategy beyond the event itself. complete article Full Article
ca 8 Ways Your Business Can Stand Out on Social Media By www.rss-specifications.com Published On :: Wed, 16 Oct 2019 18:13:18 -0400 1. Plan a content strategy and create an editorial calendar for your social channels. Marketers are sometimes at a loss at what to post on social media. Successful social media marketing doesn't happen on accident -- there's a strategy in place, just as there is with a blog. Look at the big picture and come up with social content that will resonate with your audience. Map out seasonal content, as well as content related to events or launches your company is planning. Work closely with your editorial and marketing teams to know what's coming down the pipeline and strategize the best ways to promote it. complete article Full Article
ca Why You Need an RSS Feed for Your Podcast (+How to Make One) By www.rss-specifications.com Published On :: Wed, 20 Nov 2019 09:46:24 -0400 The method of getting your podcast out to the world might not be the way you think. Unlike most popular forms of online content, podcasts utilize a form of forbidden arcane knowledge; an ancient method of internet distribution discussed in hushed tones and under furtive glances as really simple syndication or RSS for short. Learning how to make your own podcast-only RSS feed is a crucial element for any successful show. complete article Full Article
ca The Most Captivating Brand Campaigns We Saw on Social Media in 2019 By www.rss-specifications.com Published On :: Wed, 8 Jan 2020 18:14:10 -0500 For the past decade, brands have been capitalizing on the pervasiveness of social media in consumers’ daily lives and shopping habits. And this past year was no different. Social media analytics company Unmetric found that brands that promoted messaging with edge, savvy, conviction—and occasionally dogs—won the marketing game. Of that messaging, video—particularly those with memorable storylines, guest appearances or creative approaches to addressing social issues—reined as the overall best-performing format for branded and original content, a consistent trend in their numbers since at least 2015. The Most Captivating Brand Campaigns We Saw on Social Media in 2019 Full Article
ca How This Social Media Agency Is Revolutionizing The Influencer Marketing Landscape By www.rss-specifications.com Published On :: Thu, 30 Jan 2020 19:03:18 -0500 Is influencer marketing becoming a strategy of the past? Are influencers worth what brands pay them to endorse their products? How This Social Media Agency Is Revolutionizing The Influencer Marketing Landscape Full Article
ca Why You Need an RSS Feed for Your Podcast (+How to Make One) By www.rss-specifications.com Published On :: Mon, 2 Mar 2020 12:40:09 -0500 The method of getting your podcast out to the world might not be the way you think. Unlike most popular forms of online content, podcasts utilize a form of forbidden arcane knowledge; an ancient method of internet distribution discussed in hushed tones and under furtive glances as really simple syndication or RSS for short. Learning how to make your own podcast-only RSS feed is a crucial element for any successful show. Feel free to jump to a section of your choosing if you’re looking for something in particular: What is a podcast-only RSS feed? Why you need a podcast-only RSS feed How to craft a podcast-only RSS feed How to switch to a podcast-only RSS feed complete article Full Article
ca Why 2020 Is A Critical Global Tipping Point For Social Media By www.rss-specifications.com Published On :: Mon, 6 Apr 2020 13:10:15 -0500 This year is likely the last one ever in which you can say that more than half the planet is not on social media. Hootsuite just released a massive digital state of the union report. Some of the high-level findings: 5.2 billion of us now have phones globally 4.5 billion are connected to the internet 3.8 billion are active social media users That 3.8 billion is 49% of the planets population, and it grew 9% over the past year. That means it is extremely likely that sometime this calendar year, more than half of all of us will be active social media users. complete article Full Article
ca Facebook spies on us but not by recording our calls By www.rss-specifications.com Published On :: Fri, 1 May 2020 16:50:45 -0400 A 2019 study by the Pew Research Center showed that 51% of the people surveyed said they were uncomfortable with being tracked and categorized by Facebook. complete article Full Article
ca Are Influencers the Escape Social Media Wants During Coronavirus? By www.rss-specifications.com Published On :: Mon, 11 May 2020 17:03:30 -0400 Self-quarantining during COVID-19 has caused some, especially those in the travel industry, to take a bigger hit than others. Those who usually work from home have had to make less of an adjustment, though booking paid partnerships is a struggle industry-wide. As a result, many influencers are getting creative with their social strategies. Those who are multiplatform and have more than one revenue stream are coming out on top. complete article Full Article
ca Why You Need an RSS Feed for Your Podcast By www.rss-specifications.com Published On :: Fri, 5 Jun 2020 06:35:31 -0400 The method of getting your podcast out to the world might not be the way you think. Unlike most popular forms of online content, podcasts utilize a form of forbidden arcane knowledge; an ancient method of internet distribution discussed in hushed tones and under furtive glances as really simple syndication or RSS for short. First of all, we need to draw a critical distinction between traditional RSS feeds and podcast-only RSS feeds. An RSS feed is a format of internet file that can contain any sort of content, while the podcast-only variety is, unsurprisingly restricted to only podcasts. A podcast-only RSS feed is a subtype of the internet file type known as RSS. This file can be easily distributed to a variety of different directories that updates the displayed content in real time alongside changes made by the creator. This format restriction is what allows podcast directories to so easily display and showcase new content; everything that is submitted is, from a technical standpoint, completely identical! Full Article
ca Impact mechanics / W.J. Stronge, University of Cambridge By library.mit.edu Published On :: Sun, 30 Jun 2019 06:40:10 EDT Barker Library - TA354.S77 2019 Full Article
ca 43 Covid-19 cases on Saturday, active count below 1000 in Andhra Pradesh By timesofindia.indiatimes.com Published On :: Sat, 09 May 2020 15:34:17 IST Full Article
ca Four new cases of Covid-19 reported in Uttarakhand today By timesofindia.indiatimes.com Published On :: Sat, 09 May 2020 15:54:19 IST Full Article
ca Private mobile phones restored in Kashmir; situation remains calm By timesofindia.indiatimes.com Published On :: Sat, 09 May 2020 15:58:16 IST Full Article
ca Testing capacity for Covid-19 scaled up to 95,000 per day: Harsh Vardhan By timesofindia.indiatimes.com Published On :: Sat, 09 May 2020 18:41:25 IST The testing capacity for Covid-19 has been scaled up to around 95,000 tests per day and a total of 15,25,631 tests have been conducted so far across 332 government and 121 private laboratories, Union Health Minister Harsh Vardhan said on Saturday. The minister reviewed the status of Covid-19 in the northeastern states along with the measures taken for its containment. Full Article
ca West Bengal govt allows 10 trains carrying migrant labourers to enter state By timesofindia.indiatimes.com Published On :: Sat, 09 May 2020 19:13:38 IST Full Article
ca 49ers investigating training camp sites outside California By sports.yahoo.com Published On :: Fri, 08 May 2020 21:28:16 GMT The Cowboys still hope to hold training camp in Oxnard, California, this summer. The 49ers, Raiders, Chargers and Rams also are planning to have camp in California. But California was among the first states to entact stay-at-home orders and is expected to be among the last to allow large groups to convene. That means all [more] Full Article article Sports
ca 49ers schedule 2020: Predicting why they can, can't match 2019 success By sports.yahoo.com Published On :: Fri, 08 May 2020 22:14:31 GMT The 49ers are going to be good next season. But how good? Full Article article News
ca 'Around The NFL': Can't-miss games on 2020 schedule By sports.yahoo.com Published On :: Fri, 08 May 2020 22:20:47 GMT The '"Around The NFL" crew list their can't-miss games on 2020 schedule. Full Article video News
ca Patriots Talk Podcast: Schedule breakdown like no other with Tom E. Curran and Phil Perry By sports.yahoo.com Published On :: Fri, 08 May 2020 22:49:12 GMT The new era of New England Patriots football has its schedule and Tom E. Curran and Phil Perry are breaking it down on the latest edition of Curran's Patriots Talk Podcast. Full Article article Sports