ter Heterogeneous Li coordination in solvent-in-salt electrolytes enables high Li transference numbers By pubs.rsc.org Published On :: Faraday Discuss., 2024, 253,343-364DOI: 10.1039/D4FD00012A, Paper Open Access   This article is licensed under a Creative Commons Attribution 3.0 Unported Licence.Anne Hockmann, Florian Ackermann, Diddo Diddens, Isidora Cekic-Laskovic, Monika SchönhoffUnusually high Li transference numbers (t+ > 0.7) in a bisolvent-in-salt electrolyte are explained by a heterogeneous Li solvation structure, which yields two distinctly different Li species with different transport behavior.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
ter Overdetermination method for accurate dynamic ion correlations in highly concentrated electrolytes By pubs.rsc.org Published On :: Faraday Discuss., 2024, 253,100-117DOI: 10.1039/D4FD00034J, Paper Open Access   This article is licensed under a Creative Commons Attribution 3.0 Unported Licence.Tabita Pothmann, Maleen Middendorf, Christian Gerken, Pinchas Nürnberg, Monika Schönhoff, Bernhard RolingAn experimental overdetermination method and a Reverse Monte Carlo-based approach lead to strongly reduced uncertainties of transport parameters for highly concentrated electrolytes and to accurate information about ion correlations and transport limitations in batteries.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
ter Speciation of the proton in water-in-salt electrolytes By pubs.rsc.org Published On :: Faraday Discuss., 2024, 253,478-492DOI: 10.1039/D4FD00027G, PaperKateryna Goloviznina, Alessandra Serva, Mathieu SalanneIn 21 m LiTFSI water-in-salt electrolyte, the proton forms species existing in bulk water (H3O+, H5O2+, etc.) as well as the HTFSI acid, known to be a superacid in water.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
ter Linear ether-based highly concentrated electrolytes for Li–sulfur batteries By pubs.rsc.org Published On :: Faraday Discuss., 2024, 253,385-406DOI: 10.1039/D4FD00024B, PaperToru Ishikawa, Shohei Haga, Keisuke Shigenobu, Taku Sudoh, Seiji Tsuzuki, Wataru Shinoda, Kaoru Dokko, Masayoshi Watanabe, Kazuhide UenoLinear ether-based electrolytes show low solubility of the sulfur species, stability towards Li metal and polysulfide nucleophiles. Li–S cells using the lightweight electrolyte demonstrated an energy density exceeding 300 W h kg−1.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
ter New directions in experiment and theory, interfaces, and interactions: general discussion By pubs.rsc.org Published On :: Faraday Discuss., 2024, 253,493-509DOI: 10.1039/D4FD90037E, DiscussionRob Atkin, Duncan W. Bruce, Robert A. W. Dryfe, Emmanuelle Dubois, Karen J. Edler, Christopher E. Elgar, Andrew Feeney, Kateryna Goloviznina, Timothy S. Groves, Benworth Hansen, John D. Holbrey, Christian Holm, Alexei Kornyshev, Claudio J. Margulis, Daniel M. Markiewitz, Richard P. Matthews, Joshua Maurer, Shurui Miao, Frederik Philippi, Elixabete Rezabal, Bernhard Roling, Benjamin Rotenberg, Joshua Sangoro, Monika Schönhoff, John M. Slattery, Małgorzata Swadźba-Kwaśny, Neave Taylor, Masayoshi Watanabe, Jake YangThe content of this RSS Feed (c) The Royal Society of Chemistry Full Article
ter Adsorption and vibrational spectroscopy of CO on the surface of MgO from periodic local coupled-cluster theory By pubs.rsc.org Published On :: Faraday Discuss., 2024, 254,628-640DOI: 10.1039/D4FD00041B, Paper Open Access   This article is licensed under a Creative Commons Attribution-NonCommercial 3.0 Unported Licence.Hong-Zhou Ye, Timothy C. BerkelbachLocal correlation allows accurate periodic CCSD(T) calculations to be efficiently performed for molecules on realistic surfaces with large basis sets, yielding accurate adsorption energies and vibrational frequencies.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
ter Accelerated basis-set convergence of coupled-cluster excitation energies using the density-based basis-set correction method By pubs.rsc.org Published On :: Faraday Discuss., 2024, 254,315-331DOI: 10.1039/D4FD00033A, PaperDiata Traore, Julien Toulouse, Emmanuel GinerWe present the first application to real molecular systems of the recently proposed linear-response theory for the density-based basis-set correction method [J. Chem. Phys., 158, 234107 (2023)].The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
ter Classification and quantitative characterisation of the excited states of π-conjugated diradicals By pubs.rsc.org Published On :: Faraday Discuss., 2024, 254,107-129DOI: 10.1039/D4FD00055B, Paper Open Access   This article is licensed under a Creative Commons Attribution 3.0 Unported Licence.Lujo Matasović, Hugo Bronstein, Richard H. Friend, Felix PlasserA detailed classification scheme for the excited states of diradicals is presented highlighting the connections between the states of closed-shell and open-shell molecules.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
ter Fast and accurate nonadiabatic molecular dynamics enabled through variational interpolation of correlated electron wavefunctions By pubs.rsc.org Published On :: Faraday Discuss., 2024, 254,542-569DOI: 10.1039/D4FD00062E, Paper Open Access   This article is licensed under a Creative Commons Attribution 3.0 Unported Licence.Kemal Atalar, Yannic Rath, Rachel Crespo-Otero, George H. BoothEfficient multi-state interpolation of many-body wavefunctions enables rigorous nonadiabatic molecular dynamics with analytical forces and nonadiabatic coupling vectors.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
ter CO adsorption on Pt(111) studied by periodic coupled cluster theory By pubs.rsc.org Published On :: Faraday Discuss., 2024, 254,586-597DOI: 10.1039/D4FD00085D, Paper Open Access   This article is licensed under a Creative Commons Attribution 3.0 Unported Licence.Johanna P. Carbone, Andreas Irmler, Alejandro Gallo, Tobias Schäfer, William Z. Van Benschoten, James J. Shepherd, Andreas GrüneisApplication of periodic coupled-cluster theory for CO adsorption energies on the Pt(111) surface. The adsorption energy at the top site is mainly electrostatic, while at the fcc site it is correlation-based. This difference might account for the challenges DFT faces with the CO puzzle.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
ter Multi-reference coupled cluster theory using the normal ordered exponential ansatz By pubs.rsc.org Published On :: Faraday Discuss., 2024, 254,170-190DOI: 10.1039/D4FD00044G, PaperAlexander D. Gunasekera, Nicholas Lee, David P. TewWe examine Lindgren's normal-ordered exponential ansatz to correlate specific spin states using spin-free excitation operators, with the aid of automatic equation generation software.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
ter Here’s How 11 Expert Marketers Define B2B Influencer Marketing By www.toprankmarketing.com Published On :: Wed, 28 Aug 2024 13:00:41 +0000 What is B2B influencer marketing? I get asked this question quite often. Especially by non-marketers, who have the assumption I... The post Here’s How 11 Expert Marketers Define B2B Influencer Marketing appeared first on TopRank® Marketing. Full Article Influencer Marketing
ter DNA TV Show: Terror threat in Delhi after Rohini blast? Police tighten security ahead of Diwali By www.dnaindia.com Published On :: Mon, 21 Oct 2024 18:23:38 GMT Many revelations are being made in the investigation of this bomb blast. The connection of the blasts is also being linked to Khalistan. Full Article Analysis
ter How Biden's Lame-Duck Period Could Influence Policy Decisions After Choosing Not to Run in 2024 By www.dnaindia.com Published On :: Thu, 07 Nov 2024 14:57:50 GMT Joe Biden no longer needs to be concerned about how his actions may affect Kamala Harris's chances, as she is no longer in the race. Full Article Analysis
ter Sanju Samson Birthday: Unique record held by Kerala cricketer in T20I that even MS Dhoni couldn't attain By www.dnaindia.com Published On :: Mon, 11 Nov 2024 05:56:00 GMT Samson's journey has not been easy. New T20 captain Suryakumar Yadav and head coach Gautam Gambhir gave him confidence after a disappointing tour of Sri Lanka earlier this year when he struggled with form Full Article Sports Cricket
ter IND vs SA: Varun Chakravarthy takes 5-wicket-haul but enters THIS unwanted record in 2nd T20I By www.dnaindia.com Published On :: Mon, 11 Nov 2024 13:49:00 GMT South Africa on Sunday secured a three-wicket win against India in the second T20I to level the series 1-1. Full Article Sports Cricket
ter Champions Trophy: PCB to seek clarity from ICC after BCCI refuses to send Indian team to Pakistan By www.dnaindia.com Published On :: Mon, 11 Nov 2024 15:15:00 GMT The PCB was told by the ICC that BCCI won't send its team to Pakistan after the decision was communicated to the world governing body. Full Article Sports Cricket
ter Meet Ayush Mhatre, 17-year-old Mumbai batter who impressed MS Dhoni, CSK ahead of IPL 2025 mega auction By www.dnaindia.com Published On :: Tue, 12 Nov 2024 12:56:00 GMT Ayush has reportedly been called for CSK trials after the 5th round of the Ranji Trophy. Full Article Sports Cricket
ter Sustainability Takes Center Stage in US Manufacturing with Leader Viralsinh Solanki at the Forefront By www.dnaindia.com Published On :: Mon, 11 Nov 2024 13:06:36 GMT Viralsinh, a visionary software developer and manufacturing expert, has introduced state-of-the-art technologies such as the manufacturing execution system (MES). Full Article India
ter J-K: Gunfight underway between security forces and terrorists in Bandipora By www.dnaindia.com Published On :: Tue, 12 Nov 2024 08:06:00 GMT After suspicious activity was observed, the security forces challenged the terrorists, who fired at the forces. The firing was effectively retaliated, leading to the encounter. Full Article India
ter After returning as President, what will happen to cases against Donald Trump? Know here By www.dnaindia.com Published On :: Thu, 07 Nov 2024 07:47:00 GMT Trump's electoral victory has fundamentally remade the political landscape and has sent the legal world into uncharted territory Full Article World
ter Donald Trump's second term worries Elon Musk's transgender daughter, says.... By www.dnaindia.com Published On :: Fri, 08 Nov 2024 03:11:00 GMT Wilson on Thursday announced her plans to leave America after Donald Trump reclaimed the US presidency. She said that she doesn't see a future in the country. Full Article World
ter President Joe Biden reacts to Trump's victory, assures 'peaceful transfer of power', appeals Democratic supporters to.. By www.dnaindia.com Published On :: Fri, 08 Nov 2024 03:53:00 GMT Donald Trump, who lost the 2020 elections to President Biden, pulled off an incredible comeback, wresting 295 electoral college votes against Harris' 226 in a fierce contest that almost left the Americans with two world views. Full Article World
ter 'Echo dark moments in history': US President Biden condemns 'antisemitic' attacks on Israeli soccer fans in Amsterdam By www.dnaindia.com Published On :: Sat, 09 Nov 2024 01:50:00 GMT Joe Biden's statement comes a day after Israeli soccer fans were assaulted by young people in hit-and-run scooter attacks. Dutch authorities said the incident was likely a result of calls on social media to attack Jewish people. Full Article World
ter Donald Trump marks second term victory with formation of inaugural committee for 2025 By www.dnaindia.com Published On :: Sun, 10 Nov 2024 02:16:00 GMT President-elect Donald Trump announced the formation of his inaugural committee which will organize and celebrate his inauguration on January 20, 2025. This follows Trump's victory in the 2024 US presidential election, securing his second term in the White House after a comeback from his loss to President Joe Biden in 2020. Full Article World
ter Can Kamala Harris still become US President after losing election to Donald Trump? Know how it's possible By www.dnaindia.com Published On :: Tue, 12 Nov 2024 09:58:00 GMT Some Democrats urge President Biden to step down so Kamala Harris despite losing to Trump to become the first... Full Article World
ter Meet woman, whose family was ashamed of her business, later her company was acquired by Mukesh Ambani, she is... By www.dnaindia.com Published On :: Mon, 11 Nov 2024 12:44:00 GMT In 2016, she introduced Zivame Studios, creating an omni-channel experience and expanding Zivame's presence into tier 2 and tier 3 cities across India. Full Article Business
ter Meet man who leads Rs 243890 crore company, lost Rs 21735 crore in one day after... By www.dnaindia.com Published On :: Mon, 11 Nov 2024 13:55:29 GMT He joined the company as a management graduate and initially spent eight years in sales. Full Article Business
ter What Elon Musk-owned Starlink requires to get licence for services in India? Union Minister Jyotiraditya Scindia says.. By www.dnaindia.com Published On :: Tue, 12 Nov 2024 09:08:00 GMT The minister said the satellite internet services provider is in the process of completing all the requirements and they will get a licence once they complete the process. Full Article Business
ter Meet woman who left corporate world to start her company, daughter-in-law of Indian billioniare, runs... By www.dnaindia.com Published On :: Tue, 12 Nov 2024 11:41:36 GMT She pursued an MBA at The Wharton School of the University of Pennsylvania, US. Her initial career began in pharmaceuticals at Pfizer. Full Article Business
ter Man claims he received 0.5 gm gold coin instead of 1 gm from Blinkit on Dhanteras, know what happened next By www.dnaindia.com Published On :: Wed, 30 Oct 2024 04:45:00 GMT Delhi man allegedly 'got scammed' on Blinkit, claiming that he received 0.5gm gold coin on Dhanteras instead of 1gm gold coin that he ordered. Full Article Bangalore Big Picture Viral
ter India's biggest hit film released in 1988, made heroine a superstar after 10 flop films, is related to SRK, earned Rs.. By www.dnaindia.com Published On :: Tue, 12 Nov 2024 12:25:14 GMT Tezaab, released in November 1988, was a major commercial success at the box office, becoming the highest-grossing Indian film of the year. Running in theatres for over 50 weeks, it achieved Golden Jubilee status. Full Article Entertainment Bollywood
ter Malayalam actor Siddique gets relief in rape case, Supreme Court extends interim protection from arrest By www.dnaindia.com Published On :: Tue, 12 Nov 2024 14:24:42 GMT The Supreme Court bench passed the order after senior advocate Mukul Rohatgi, appearing for Siddique, said he had a bad throat and sought some time to argue the matter. Full Article Entertainment
ter Yaariyan actor Himansh Kohli ties the knot with mystery girl in Delhi temple, first wedding pics out By www.dnaindia.com Published On :: Tue, 12 Nov 2024 15:01:00 GMT Himansh Kohli was previously in a relationship with singer Neha Kakkar, but they parted ways in December 2018 after dating for a year. Full Article Entertainment Bollywood
ter Arjun Kapoor has 'a long way to go' to form deep-rooted bond with step sisters Janhvi, Khushi Kapoor: 'We are still...' By www.dnaindia.com Published On :: Tue, 12 Nov 2024 15:57:15 GMT Talking about his bond with Janhvi Kapoor and Khushi Kapoor, Arjun Kapoor said, "You can't build relationships on just praise. You have to be able to call each other out when needed." Full Article Entertainment Bollywood
ter Good news for Noida, Greater Noida residents as new metro line to Jewar Airport gets... By www.dnaindia.com Published On :: Sat, 05 Oct 2024 06:22:00 GMT The metro line project to Jewar Airport has been a long pending demand of the residents of Greater Noida and Noida. Full Article India Delhi
ter Manu Bhaker attends her alma mater's award ceremony in Delhi University, says 'people think girls from LSR are...' By www.dnaindia.com Published On :: Sat, 12 Oct 2024 03:52:26 GMT Olympians Manu Bhaker, Maheshwari Chauhan, and Rhythm Sangwan, all former students of the prestigious Lady Shri Ram College, Delhi University were recently honoured by the college. Full Article India Delhi
ter Delhi to launch 'E-Detection' system: Here's how it will prevent polluting vehicles from entering By www.dnaindia.com Published On :: Sat, 12 Oct 2024 12:41:00 GMT India to launch an e-detection system to identify old and polluting vehicles in Delhi before Diwali. Full Article India Delhi
ter Delhi-NCR update: Jewar Airport to run 25 domestic, three international flights on first day of operations By www.dnaindia.com Published On :: Sun, 20 Oct 2024 01:48:19 GMT Noida International Airport, named Jewar Airport, is set to start commercial flight operations on April 17, 2025. Full Article India Delhi
ter Delhi to face water shortage amid Diwali festivities till...; check list of affected areas By www.dnaindia.com Published On :: Mon, 28 Oct 2024 12:55:00 GMT Several parts of east, northeast and south Delhi and areas under the New Delhi Municipal Council will be affected, it said. Full Article India Delhi
ter Delhi's air quality deteriorates to 'very poor' category, likely to worsen after festival By www.dnaindia.com Published On :: Thu, 31 Oct 2024 13:05:00 GMT Delhi's air quality continued to deteriorate, remaining in the "very poor" category on Diwali, with levels expected to worsen to the "severe" category due to bursting of firecrackers at night. Full Article India Delhi
ter Swati Maliwal pours bottle of polluted water outside Delhi CM Atishi's residence; WATCH By www.dnaindia.com Published On :: Sat, 02 Nov 2024 13:58:24 GMT She also placed the bottle of polluted water just outside the gate of Chief Minister Atishi's residence. Full Article India Delhi
ter Critical review of fluorescence and absorbance measurements as surrogates for the molecular weight and aromaticity of dissolved organic matter By pubs.rsc.org Published On :: Environ. Sci.: Processes Impacts, 2024, 26,1663-1702DOI: 10.1039/D4EM00183D, Critical Review Open Access   This article is licensed under a Creative Commons Attribution-NonCommercial 3.0 Unported Licence.Julie A. Korak, Garrett McKayOptical surrogates are used to characterize dissolved organic matter composition like aromaticity and molecular weight. We both review the genesis of surrogate-composition relationships and critically evaluate additional supporting evidence.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
ter Vehicular pollution as the primary source of oxidative potential of PM2.5 in Bhubaneswar, a non-attainment city in eastern India By pubs.rsc.org Published On :: Environ. Sci.: Processes Impacts, 2024, 26,1716-1735DOI: 10.1039/D4EM00150H, PaperSubhasmita Panda, Chinmay Mallik, S. Suresh Babu, Sudhir Kumar Sharma, Tuhin Kumar Mandal, Trupti Das, R. BoopathyOverview of major PM2.5 sources responsible for catalytic ROS production.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
ter Erosion of rigid plastics in turbid (sandy) water: quantitative assessment for marine environments and formation of microplastics By pubs.rsc.org Published On :: Environ. Sci.: Processes Impacts, 2024, 26,1847-1858DOI: 10.1039/D4EM00122B, PaperAli Al-Darraji, Ibukun Oluwoye, Christopher Lagat, Shuhei Tanaka, Ahmed BarifcaniMechanical degradation (erosion) of plastics in the marine environment has been reported in many literature studies but without quantitative information. Therefore, this study quantified the erosion of some plastics in the marine environment.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
ter Fungal diversity and key functional gene abundance in Iowa bioretention cells: implications for stormwater remediation potential By pubs.rsc.org Published On :: Environ. Sci.: Processes Impacts, 2024, 26,1796-1810DOI: 10.1039/D4EM00275J, Paper Open Access   This article is licensed under a Creative Commons Attribution 3.0 Unported Licence.Erica A. Wiener, Jessica M. Ewald, Gregory H. LeFevreFungal communities within bioretention cells were diverse, including taxa capable of biodegrading recalcitrant contaminants, and influenced by plant type. Fungal functional genes demonstrate bioremediation potential in stormwater infrastructure.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
ter Experimental assessment of low temperature plasma devices for bacterial aerosol inactivation in the air duct of HVAC systems By pubs.rsc.org Published On :: Environ. Sci.: Processes Impacts, 2024, 26,1836-1846DOI: 10.1039/D4EM00158C, PaperYang Lv, Xiaodong Wang, Beibei Wang, Wenjie YuanThis study evaluates the effectiveness of low temperature plasma (LTP) devices in the air duct of HVAC systems, achieving 82% bacterial aerosol inactivation under optimal conditions, advocating their use in public buildings to improve air quality.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
ter Microplastics are effective carriers of bisphenol A and facilitate its escape from wastewater treatment systems By pubs.rsc.org Published On :: Environ. Sci.: Processes Impacts, 2024, 26,1811-1820DOI: 10.1039/D4EM00297K, PaperWang Li, Bo zu, Lei Li, Jian Li, Jiawen Li, Qiujie XiangMicroplastics (MPs) pollution is a major issue in aquatic environments.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
ter Depletion rates of O2-naphthenic acids from oil sands process-affected water in wetland microcosms By pubs.rsc.org Published On :: Environ. Sci.: Processes Impacts, 2024, 26,1859-1867DOI: 10.1039/D4EM00227J, PaperAlexander M. Cancelli, Frank A. P. C. GobasDepuration in OSPW occurs by mechanisms of natural attenuation, sorption and microbial degradation, and plant-mediated uptake and biotransformation.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
ter Storms mobilize organophosphate esters, bisphenols, PFASs, and vehicle-derived contaminants to San Francisco Bay watersheds By pubs.rsc.org Published On :: Environ. Sci.: Processes Impacts, 2024, 26,1760-1779DOI: 10.1039/D4EM00117F, Paper Open Access   This article is licensed under a Creative Commons Attribution-NonCommercial 3.0 Unported Licence.Katherine T. Peter, Alicia Gilbreath, Melissa Gonzalez, Zhenyu Tian, Adam Wong, Don Yee, Ezra L. Miller, Pedro M. Avellaneda, Da Chen, Andrew Patterson, Nicole Fitzgerald, Christopher P. Higgins, Edward P. Kolodziej, Rebecca SuttonWe evaluated the occurrence of 154 organic contaminants from multiple chemical/use classes in San Francisco Bay watersheds during storm events, revealing complex mixtures and high concentrations transported to receiving waters.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article