Search Results - "Bartel, J."

Machine learning for heterogeneous catalyst design and discovery by Goldsmith, Bryan R., Esterhuizen, Jacques, Liu, Jin‐Xun, Bartel, Christopher J., Sutton, Christopher

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Probabilistic Deep Learning Approach to Automate the Interpretation of Multi-phase Diffraction Spectra by Szymanski, Nathan J, Bartel, Christopher J, Zeng, Yan, Tu, Qingsong, Ceder, Gerbrand

“…Autonomous synthesis and characterization of inorganic materials require the automatic and accurate analysis of X-ray diffraction spectra. For this task, we…”
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An autonomous laboratory for the accelerated synthesis of novel materials by Szymanski, Nathan J., Rendy, Bernardus, Fei, Yuxing, Kumar, Rishi E., He, Tanjin, Milsted, David, McDermott, Matthew J., Gallant, Max, Cubuk, Ekin Dogus, Merchant, Amil, Kim, Haegyeom, Jain, Anubhav, Bartel, Christopher J., Persson, Kristin, Zeng, Yan, Ceder, Gerbrand

“…To close the gap between the rates of computational screening and experimental realization of novel materials 1 , 2 , we introduce the A-Lab, an autonomous…”
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A map of the inorganic ternary metal nitrides by Sun, Wenhao, Bartel, Christopher J., Arca, Elisabetta, Bauers, Sage R., Matthews, Bethany, Orvañanos, Bernardo, Chen, Bor-Rong, Toney, Michael F., Schelhas, Laura T., Tumas, William, Tate, Janet, Zakutayev, Andriy, Lany, Stephan, Holder, Aaron M., Ceder, Gerbrand

“…Exploratory synthesis in new chemical spaces is the essence of solid-state chemistry. However, uncharted chemical spaces can be difficult to navigate,…”
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New tolerance factor to predict the stability of perovskite oxides and halides by Bartel, Christopher J, Sutton, Christopher, Goldsmith, Bryan R, Ouyang, Runhai, Musgrave, Charles B, Ghiringhelli, Luca M, Scheffler, Matthias

“…Predicting the stability of the perovskite structure remains a long-standing challenge for the discovery of new functional materials for many applications…”
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Physical descriptor for the Gibbs energy of inorganic crystalline solids and temperature-dependent materials chemistry by Bartel, Christopher J., Millican, Samantha L., Deml, Ann M., Rumptz, John R., Tumas, William, Weimer, Alan W., Lany, Stephan, Stevanović, Vladan, Musgrave, Charles B., Holder, Aaron M.

“…The Gibbs energy, G , determines the equilibrium conditions of chemical reactions and materials stability. Despite this fundamental and ubiquitous role, G has…”
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Synthetic accessibility and stability rules of NASICONs by Ouyang, Bin, Wang, Jingyang, He, Tanjin, Bartel, Christopher J., Huo, Haoyan, Wang, Yan, Lacivita, Valentina, Kim, Haegyeom, Ceder, Gerbrand

“…In this paper we develop the stability rules for NASICON-structured materials, as an example of compounds with complex bond topology and composition. By…”
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A critical examination of compound stability predictions from machine-learned formation energies by Bartel, Christopher J., Trewartha, Amalie, Wang, Qi, Dunn, Alexander, Jain, Anubhav, Ceder, Gerbrand

“…Machine learning has emerged as a novel tool for the efficient prediction of material properties, and claims have been made that machine-learned models for the…”
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Autonomous and dynamic precursor selection for solid-state materials synthesis by Szymanski, Nathan J., Nevatia, Pragnay, Bartel, Christopher J., Zeng, Yan, Ceder, Gerbrand

“…Solid-state synthesis plays an important role in the development of new materials and technologies. While in situ characterization and ab-initio computations…”
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Toward autonomous design and synthesis of novel inorganic materials by Szymanski, Nathan J, Zeng, Yan, Huo, Haoyan, Bartel, Christopher J, Kim, Haegyeom, Ceder, Gerbrand

“…Autonomous experimentation driven by artificial intelligence (AI) provides an exciting opportunity to revolutionize inorganic materials discovery and…”
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Solving the eigenvalue problem of the nuclear Yukawa-folded mean-field Hamiltonian by Dobrowolski, A., Pomorski, K., Bartel, J.

“…The nuclear Hamiltonian with a Yukawa-folded mean-field potential is diagonalized within the basis of a deformed harmonic-oscillator in Cartesian coordinates…”
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Operando X‑ray Diffraction Studies of the Mg-Ion Migration Mechanisms in Spinel Cathodes for Rechargeable Mg-Ion Batteries by Yin, Liang, Kwon, Bob Jin, Choi, Yunyeong, Bartel, Christopher J, Yang, Mengxi, Liao, Chen, Key, Baris, Ceder, Gerbrand, Lapidus, Saul H

“…A promising high-voltage spinel oxide cathode material MgCrMnO4 with 18% Mg/Mn inversion was synthesized successfully. A new custom operando battery device was…”
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Kinetically Controlled Low-Temperature Solid-State Metathesis of Manganese Nitride Mn3N2 by Rognerud, Erik G, Rom, Christopher L, Todd, Paul K, Singstock, Nicholas Ryan, Bartel, Christopher J, Holder, Aaron M, Neilson, James R

“…The synthesis of inorganic metal nitrides poses a challenge due to the low reactivity of N2 gas at low temperatures, yet entropy driven formation of N2 gas at…”
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Intracerebral gadolinium deposition following blood–brain barrier disturbance in two different mouse models by Kromrey, M. L., Oswald, S., Becher, D., Bartel, J., Schulze, J., Paland, H., Ittermann, T., Hadlich, S., Kühn, J. P., Mouchantat, S.

“…To evaluate the influence of the blood–brain barrier on neuronal gadolinium deposition in a mouse model after multiple intravenous applications of the linear…”
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Pancreatic exocrine insufficiency in pancreatic cancer: A review of the literature by Bartel, Michael J, Asbun, Horatio, Stauffer, John, Raimondo, Massimo

“…Abstract Pancreatic exocrine insufficiency is a well-documented complication of chronic pancreatitis; however, study results of pancreatic exocrine…”
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Cyst carcinoembryonic antigen in differentiating pancreatic cysts: A meta-analysis by Ngamruengphong, Saowanee, Bartel, Michael J, Raimondo, Massimo

“…Abstract Background Using carcinoembryonic antigen in discriminating between benign and malignant disease remains controversial. Aims We aim to evaluate the…”
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Review of computational approaches to predict the thermodynamic stability of inorganic solids by Bartel, Christopher J.

“…Improvements in the efficiency and availability of quantum chemistry codes, supercomputing centers, and open materials databases have transformed the…”
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Pandemic-Related Changes in Alcohol and Cannabis Use: Comparing Retrospective Reports and Prospective Data by Bartel, S. J., Sherry, S. B., Stewart, S. H.

“…[...]it is unclear what impact the pandemic has had on certain populations which tend to have higher levels of risky substance use, such as emerging adults…”
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Adaptively driven X-ray diffraction guided by machine learning for autonomous phase identification by Szymanski, Nathan J., Bartel, Christopher J., Zeng, Yan, Diallo, Mouhamad, Kim, Haegyeom, Ceder, Gerbrand

“…Machine learning (ML) has become a valuable tool to assist and improve materials characterization, enabling automated interpretation of experimental results…”
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Design of a scanning gate microscope for mesoscopic electron systems in a cryogen-free dilution refrigerator by Pelliccione, M, Sciambi, A, Bartel, J, Keller, A J, Goldhaber-Gordon, D

“…We report on our design of a scanning gate microscope housed in a cryogen-free dilution refrigerator with a base temperature of 15 mK. The recent increase in…”
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