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您的检索式：作者名="Andrea Centrone"
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| 1 | The joint automated repository for various integrated simulations (JARVIS) for data-driven materials design显示文摘The Joint Automated Repository for Various Integrated Simulations(JARVIS)is an integrated infrastructure to accelerate materials discovery and design using density functional theory(DFT),classical force-fields(FF),and machine learning(ML)techniques.JARVIS is motivated by the Materials Genome Initiative(MGI)principles of developing open-access databases and tools to reduce the cost and development time of materials discovery,optimization,and deployment. | Kamal Choudhary Kevin F.Garrity Andrew C.E.Reid Brian DeCost Adam J.Biacchi Angela R.Hight Walker Zachary Trautt Jason Hattrick-Simpers A.Gilad Kusne Andrea Centrone Albert Davydov Jie Jiang Ruth Pachter Gowoon Cheon Evan Reed Ankit Agrawal Xiaofeng Qian Vinit Sharma Houlong Zhuang Sergei V.Kalinin Bobby G.Sumpter Ghanshyam Pilania Pinar Acar Subhasish Mandal Kristjan Haule David Vanderbilt Karin Rabe Francesca Tavazza | 2020 | npj Computational Materials2020，，1： | 10 |
| 2 | Highly porous electrospun polyvinylidene fluoride (PVDF)-based carbon fiber显示文摘 | YANG Ying ANDREA Centrone CHEN Liang | 2011 | Carbon2011，，49： | 1 |
| 3 | Nanoscale chemical imaging of individual chemotherapeutic cytarabineloaded liposomal nanocarriers显示文摘Dosage of chemotherapeutic drugs is a tradeoff between efficacy and side-effects.Liposomes are nanocarriers that increase therapy efficacy and minimize side-effects by delivering otherwise difficult to administer therapeutics with improved efficiency and selectivity.Still,variabilities in liposome preparation require assessing drug encapsulation efficiency at the single liposome level,an information that,for non-fluorescent therapeutic cargos,is inaccessible due to the minute drug load per liposome.Photothermal induced resonance (PTIR) provides nanoscale compositional specificity,up to now,by leveraging an atomic force microscope (AFM) tip contacting the sample to transduce the sample's photothermal expansion.However,on soft samples (e.g.,liposomes) PTIR effectiveness is reduced due to the likelihood of tip-induced sample damage and inefficient AFM transduction.Here,individual liposomes loaded with the chemotherapeutic drug cytarabine are deposited intact from suspension via nano-electrospray gas-phase electrophoretic mobility molecular analysis (nES-GEMMA) collection and characterized at the nanoscale with the chemically-sensitive PTIR method.A new tapping-mode PTIR imaging paradigm based on heterodyne detection is shown to be better adapted to measure soft samples,yielding cytarabine distribution in individual liposomes and enabling classification of empty and drug-loaded liposomes.The measurements highlight PTIR capability to detect ~ 103 cytarabine molecules (~ 1.7 zmol) label-free and non-destructively. | Karin Wieland Georg Ramer Victor U. Weiss Guenter Allmaier Bemhard Lendl Andrea Centrone | 2019 | Nano Research2019，12，1： | 0 |
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