Results 251 to 260 of about 57,258 (313)

Freeze-and-Release Direct Optimization Method for Variational Calculations of Excited Electronic States. [PDF]

J Chem Theory Comput
Schmerwitz YLA, Selenius E, Levi G.
europepmc   +1 more source

Artificial Intelligence‐Assisted Workflow for Transmission Electron Microscopy: From Data Analysis Automation to Materials Knowledge Unveiling

Advanced Materials, EarlyView.
AI‐Assisted Workflow for (Scanning) Transmission Electron Microscopy: From Data Analysis Automation to Materials Knowledge Unveiling. Abstract (Scanning) transmission electron microscopy ((S)TEM) has significantly advanced materials science but faces challenges in correlating precise atomic structure information with the functional properties of ...
Marc Botifoll, Ivan Pinto‐Huguet, Enzo Rotunno, Thomas Galvani, Catalina Coll, Payam Habibzadeh Kavkani, Maria Chiara Spadaro, Yann‐Michel Niquet, Martin Børstad Eriksen, Sara Martí‐Sánchez, Georgios Katsaros, Giordano Scappucci, Peter Krogstrup, Giovanni Isella, Andreu Cabot, Gonzalo Merino, Pablo Ordejón, Stephan Roche, Vincenzo Grillo, Jordi Arbiol   +19 more
wiley   +1 more source

The Ground-Set-Cost Budgeted Maximum Coverage Problem. [PDF]

Theory Comput Syst
van Heuven van Staereling I, de Keijzer B, Schäfer G.   +2 more
europepmc   +1 more source

Mixed‐Metal Promotion in a Manganese‐Molybdenum Oxynitride as Catalyst to Integrate C─C and C─N Coupling Reactions for the Direct Synthesis of Acetonitrile from Syngas and Ammonia

Advanced Materials, EarlyView.
Transition metal oxy/carbo‐nitrides show great promise as catalysts for sustainable processes. A Mn‐Mo mixed‐metal oxynitride attains remarkable performance for the direct synthesis of acetonitrile, an important commodity chemical, via sequential C─N and C─C coupling from syngas (C1) and ammonia (N1) feedstocks.
M. Elena Martínez‐Monje, Wilson Henao, Tania Rodenas, Patricia Concepción, Virginia Pérez Dieste, Alexander Missyul, Giovanni Agostini, Gonzalo Prieto   +7 more
wiley   +1 more source

Heuristic centrality methods challenge greedy optimization in influence maximization. [PDF]

Sci Rep
Almazaydeh L, Al Tawil A, Shaban A, Al-Qudah R.   +3 more
europepmc   +1 more source

Self‐Cooling Molecular Spin Qudits

Advanced Materials, EarlyView.
A material made of [GdEr] molecular dimers can encode a qudit and perform as a magnetic refrigerant. Microwave resonant pulses coherently manipulate its 16 spin states, while direct demagnetization measurements cool the material and a device down to temperatures below 1 K.
Elías Palacios, David Aguilà, David Gracia, Diamatoula Maniaki, Leoní A. Barrios, Alessandro Chiesa, Jesús I. Martínez, Valentin Novikov, Olivier Roubeau, Stefano Carretta, Marco Evangelisti, Guillem Aromí, Fernando Luis   +12 more
wiley   +1 more source

An adaptive hybrid quadrature scheme: Combining Simpson's rule and Gaussian quadrature for enhanced numerical integration. [PDF]

PLoS One
Asgedom AA, Kefela YY.
europepmc   +1 more source

Nonlinear Feature-Based MI Detection Supported by DWT and EMD on ECG: A High-Performance Decision Support Approach. [PDF]

Biosensors (Basel)
Narin A, Keser M.
europepmc   +1 more source

Modeling the Friction Behavior of Low-Carbon Steel Sheets Using Various Machine Learning Algorithms Based on Strip Drawing Test Data. [PDF]

Materials (Basel)
Trzepieciński T.
europepmc   +1 more source

Axial X-Ray Microscopy in Nanotomography. [PDF]

Tomography
Gaikovich KP, Malyshev IV, Reunov DG, Chkhalo NI.   +3 more
europepmc   +1 more source