🧱 First Principles - 2601 · Scour

Non-adiabatic Ehrenfest dynamics with norm-conserving and ultra-soft pseudo-potentials with nuclear velocity corrections on the atomic orbitals within the Projector Augmented Wave Method framework

⚡Partial Evaluation Academic

Symmetry-Breaking Induced Spin Transport and Magneto-Optical Regulation in 2D Altermagnet Ru2MoSe4

✨Gleam Academic

Competing phases and domain structures of ferroelectric perovskites: The benefit of epitaxial (110) growth

🔍Lens Libraries

First-Principles Calculation of Superconducting $T_c$ in Superhard B-C-N Metals

🦀Smithay Academic

Plasticity of Neutron Star Crusts

🔄Bootstrapping Academic

High-density, high-mobility ultrathin spin-polarized two-dimensional electron gas at the polar/polar LaVO$_3$/KTaO$_3$ interface: Insights from first-principles calculations

📡Information Theory Academic

A spectral model of power-law decay in natural and engineered systems

🔄Systems Thinking Academic

Chiral-Angle-Controlled Altermagnetic Spin Splitting in Nanotubes

⌨️Mechanical Keyboards Academic

SLUSCHI-UP: A Web Infrastructure for SLUSCHI Melting-Temperature Calculations Using Universal Machine-Learning Interatomic Potentials

🔮Type Inference Visualization Academic

Spin-orbit torque and magnetization switching in two-dimensional ferromagnetic devices

🏰Capability Machines

Bayesian Optimization of a Multi-Product Chemical Reactor Using Composite Models and Partial Physics Knowledge

🎲Probabilistic Programming Academic

Data-driven discovery of governing differential equations across physical systems

📐Mathematical Computing Academic

An End-to-End Encrypted Control Pipeline for Multi-Agent Coordination via CKKS Homomorphic Encryption

🛡️Security Type Systems Academic

Inference in stochastic differential equations using the Laplace approximation: Demonstration and examples

🎲Probabilistic Programming Academic

Symmetry-Protected Phonon Topology and Low Lattice Thermal Conductivity in Square-Octagonal Chalcogenides

🔍Lens Libraries Academic

Deciphering the absence of charge density waves in the V-based kagome metal $\mathrm{Cs}{\mathrm{V}}_{6}{\mathrm{Sb}}_{6}$

🔍Lens Libraries

Electron-Ion Path Integral Monte Carlo with Hard Core

🎲Probabilistic Programming Academic

Inverse design of bespoke interatomic potentials via active learning by information-matching

🔍Lens Libraries Academic

Stacking-Dependent Magnetism and Tunable Half-Metallicity in Bilayer Janus 1T-MnSSe

🦀Smithay Academic

Local electronic structure and dynamics of hydrogen in $\text{CeO}_2$

📡Information Theory Academic

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