ATLAS: A Foundation Neural Sampler for Amorphous Materials
Mouyang Cheng, Denis Blessing, Botao Yu et al.
Materials Science papers — page 54
cond-mat.mtrl-sciBrowse archive
Thermal and electrical conductivity of a refractory high-entropy alloy after high-pressure torsion: Electron versus phonon contributions
Jacqueline Hidalgo-Jimenez, Payam Edalati, Md Amirul Islam et al.Doping tunable charge density waves in misfit layer compounds
Hugo Le Du, Ludovica Zullo, Justine Cordiez et al.Deciphering Mechanoluminescence: How the Nature of Mechanical Stress and Structural Dimensionality Shape Mechanisms and Responses
Alexis Duval, Xavier Rocquefelte, Yann Gueguen et al.Stereochemical Vacuum Gap Explains Out-of-Plane Thermal Insulation in MXenes
O. Mateos-Lopez, J. G. Vilhena, Isaac Armstrong et al.Phase equilibria in MnSb2Te4-GeSb2Te4 system and magnetic properties of Mn1-xGexSb2Te4 solid solutions
Fuad Safarov, Dunya Babanly, Jerome Robert et al.Alchemical thermodynamic integration for ab initio free-energy calculations in solutions
Liangrui Wei, Feng Zhang, Renata M. Wentzcovitch et al.Data-driven Design of Metal-Organic Frameworks with Tunable Negative Thermal Expansion
Prathami Divakar Kamath, Francesco Tavani, Alin Marin Elena et al.Two-Dimensional Hexagonal BX3 (X = P, As) Monolayers as High-Capacity, Fast-Charging Anode Platforms for Lithium- and Sodium-Ion Batteries
Jakkapat Seeyangnok, Joongjai Panpranot, Udomsilp PinsookSevenNet-Polar for MultiTask Prediction of Energy, Forces, Stress, and Born Effective Charges: Development and Application to ZrO2, Li3PO4, and Perovskites
Anh Khoa Augustin Lu, Shungo Arai, Yutack Park et al.A Magnon-Based Electric Field Controlled Magnetoelectric Device for Energy-Efficient Logic-in-Memory
Rongqing Cong, Sajid Husain, Yumin Su et al.Dynamics of Long-lived Carriers in Molybdenum Carbide Nanosheets
Xiangyu Zhu, Zhong Wang, Tao Li et al.Trans-scale spin Seebeck effect in nanostructured bulk composites based on magnetic insulator
Sang J. Park, Keisuke Hirata, Hossein Sepehri-Amin et al.Bayesian inference of composition-dependent phase diagrams
Timofei Miryashkin, Olga Klimanova, Vladimir Ladygin et al.Effect of independent parameters on nanoparticle sizes in magnetron-sputtering inert-gas condensation
Yizhou Wang, Evropi Toulkeridouc, Abisegapriyan K. S et al.GQD-AdsNet: Graph Neural Networks Unlock Rapid Exploration of Transition Metal Adsorption on Graphene Quantum Dots
Lara Goncebat, Rodrigo Echeveste, Matías Gerard et al.Battery Material Comparisons Should Refocus on Diffusivity with Best Practices
CJ Sturgill, Roya Rajabi, Md Abdullah Al Muhit et al.Data-Efficient Training of Linear ACE Potentials through Leverage-Guided Subset Selection of ASSYST Structure Pools
Aynour Khosravi, Marvin Poul, Jörg Neugebauer et al.Vacancy Diffusion Across FeCrAl Alloy Composition Space for Accident-Tolerant Fuel Cladding
Mihai Pitigoi, Peter HattonElectron escape probability in high-efficiency photocathodes measured by reverse-injection photovoltage
S. A. Rozhkov, D. A. Kustov, V. V. Bakin et al.Towards a universal model for spin-orbit coupled Wannier Hamiltonians
Alexander C. TynerExcitonic effects in the photocarriers dynamics of two-dimensional materials
Carlos Betancur, Gianluca Stefanucci, Enrico PerfettoMachine Learning Potential-Driven Molecular Dynamics Simulations of Dehydrogenation in Pristine and Doped MgH2
Bo Han, Jianchuan Wang, Rui Zhang et al.Phase-field modeling of TiO2 nanocarving via reaction with hydrogen-bearing gas
Alireza Seifi, Sheikh Akbar, Yanzhou JiDefect configuration, not nitrogen content, governs the mechanical integrity of nitrogen-doped graphene: a molecular dynamics study
Indranil Rudra, Jahid Emon, A. K. M. Monjur Morshed