1. Chemical Space Exploration with Artificial “Mindless” Molecules
   2025/09/02 by Thomas Gasevic, Marcel Müller, Jonathan Schöps +4 · 1 voice · 2 citations
   Chemistry · Computer Science · Materials Science · #Algorithm #Artificial intelligence #Benchmark (surveying) #Chemical space #Chemistry #Computational Drug Discovery Methods #Computer science #Crystallography and molecular interactions #Generator (circuit theory) #Machine Learning in Materials Science #Machine learning #Molecule #Physics #Power (physics) #Python (programming language) #Quantum mechanics #Set (abstract data type) #Space (punctuation) #Statistical physics #Test set #Thermodynamics
2. On learning Gaussian multi‐index models with gradient flow part I: General properties and two‐timescale learning
   2025/07/15 by Alberto Bietti, Joan Bruna, Loucas Pillaud‐Vivien · 8 citations
   Computer Science · Mathematics · #Applied mathematics #Balanced flow #Computer science #Econometrics #Flow (mathematics) #Gaussian #Gaussian Processes and Bayesian Inference #Geometry #Index (typography) #Mathematical analysis #Mathematics #Neural Networks and Applications #Physics #Statistical Methods and Inference #Statistical physics
3. Lattice gas automata with floating-point numbers: A connection between molecular dynamics and lattice Boltzmann method for quantum computers
   2025/03/31 by Antonio David Bastida Zamora, Zamora, Antonio David Bastida, Ljubomir Budinski +5 · 2 citations
   Computer Science · Engineering · #Acoustics #Advanced Memory and Neural Computing #Algorithm #Cellular automaton #Computer science #Condensed matter physics #HPP model #Lattice (music) #Lattice Boltzmann methods #Lattice field theory #Lattice gas automaton #Materials science #Mechanics #Neural Networks and Reservoir Computing #Particle in a one-dimensional lattice #Physics #Quantum #Quantum Computing Algorithms and Architecture #Quantum mechanics #Statistical physics #Stochastic cellular automaton
4. Mechanisms of Projective Composition of Diffusion Models
   2025/02/06 by Arwen Bradley, Preetum Nakkiran, Bradley, Arwen +7 · 1 voice · 5 citations
   Computer Science · Mathematics · #Advanced Mathematical Modeling in Engineering #Composition (language) #Diffusion #Linguistics #Mathematics #Philosophy #Physics #Projective test #Pure mathematics #Statistical physics #Thermodynamics
5. Page Curve and Entanglement Dynamics in an Interacting Fermionic Chain
   2025/02/05 by Rishabh Jha, Salvatore R. Manmana, Jha, Rishabh +3 · 3 citations
   Physics and Astronomy · #Chain (unit) #Dynamics (music) #FOS: Physical sciences #High Energy Physics - Theory (hep-th) #Mechanical and Optical Resonators #Physics #Quantum #Quantum Physics (quant-ph) #Quantum chaos and dynamical systems #Quantum entanglement #Quantum many-body systems #Quantum mechanics #Statistical physics #Strongly Correlated Electrons (cond-mat.str-el)
6. Aspects of spatially correlated random fields: Extreme-value statistics and clustering properties
   2025/01/29 by Ka Hei Choi, James Creswell, Choi, Ka Hei +8 · 1 citation
   Computer Science · Environmental Science · Mathematics · Physics and Astronomy · #Bayesian Methods and Mixture Models #Cluster analysis #Econometrics #Extreme value theory #Feature (linguistics) #Field (mathematics) #Fuzzy clustering #Mathematics #Pattern recognition (psychology) #Physics #Soil Geostatistics and Mapping #Statistical physics #Statistics #Theoretical and Computational Physics #Value (mathematics)
7. Solvation entropy engineering of thermogalvanic electrolytes for efficient electrochemical refrigeration
   2025/01/30 by Yilin Zeng, Boyang Yu, Ming Chen +7 · 1 voice · 5 citations
   Chemistry · Materials Science · Physics and Astronomy · #Advanced Thermodynamics and Statistical Mechanics #Advanced Thermoelectric Materials and Devices #Chemistry #Electrochemistry #Electrode #Electrolyte #Ion #Materials science #Nanotechnology #Organic chemistry #Physical chemistry #Physics #Refrigeration #Solvation #Statistical physics #Thermal Expansion and Ionic Conductivity #Thermodynamics
8. Electron dynamics induced by quantum cat-state light
   2025/01/28 by Shohei Imai, Imai, Shohei, Atsushi Ono +3 · 3 citations
   Physics and Astronomy · #Atomic physics #Computer science #Dynamics (music) #Electron #Laser-Matter Interactions and Applications #Physics #Quantum #Quantum dot #Quantum dynamics #Quantum mechanics #Quantum optics and atomic interactions #Spectroscopy and Quantum Chemical Studies #State (computer science) #Statistical physics #Work (physics)
9. Effective action for relativistic hydrodynamics from Crooks fluctuation theorem
   2025/01/08 by Nicki Mullins, Maurício Hippert, Mullins, Nicki +3 · 4 citations
   Physics and Astronomy · #Action (physics) #Black Holes and Theoretical Physics #Classical mechanics #Economics #FOS: Physical sciences #Fluctuation theorem #High Energy Physics - Phenomenology (hep-ph) #High Energy Physics - Theory (hep-th) #High-Energy Particle Collisions Research #Nuclear Theory (nucl-th) #Physics #Quantum Chromodynamics and Particle Interactions #Quantum mechanics #Statistical physics
10. Predicting fragment binding modes using customized Lennard-Jones potentials in short molecular dynamics simulations
    2024/12/23 by Christopher Vorreiter, Dina Robaa, Wolfgang Sippl · 1 voice · 1 citation
    Biochemistry, Genetics and Molecular Biology · Chemistry · #Algorithm #Chemistry #Computational chemistry #Computer science #Crystallography and molecular interactions #Dynamics (music) #Fragment (logic) #Mass Spectrometry Techniques and Applications #Molecular dynamics #Physics #Protein Structure and Dynamics #Statistical physics
11. Introduction to Black Hole Thermodynamics
    2024/12/21 by Edward Witten, Witten, Edward · 5 voices · 25 citations
    Physics and Astronomy · #Black Holes and Theoretical Physics #Black hole (networking) #Black hole thermodynamics #Computer science #Cosmology and Gravitation Theories #Entropy (arrow of time) #Physics #Relativity and Gravitational Theory #Statistical physics #Theoretical physics #Thermodynamics #gr-qc #hep-th
12. Time-changed Markov processes and space-time coupled non-local equations
    2024/12/19 by Giacomo Ascione, Ascione, Giacomo, Enrico Scalas +5 · 2 citations
    Decision Sciences · Mathematics · #Computer science #Econometrics #Markov chain #Markov process #Mathematics #Physics #Simulation Techniques and Applications #Statistical physics #Statistics
13. Efficient Scaling of Diffusion Transformers for Text-to-Image Generation
    2024/12/16 by Hao Li, Shamit Lal, Li, Hao +21 · 2 citations
    Computer Science · Engineering · Mathematics · #Artificial intelligence #Computation and Language (cs.CL) #Computer Graphics and Visualization Techniques #Computer Vision and Pattern Recognition (cs.CV) #Computer science #Diffusion #Electrical engineering #Engineering #FOS: Computer and information sciences #Geometry #Image (mathematics) #Machine Learning (cs.LG) #Mathematics #Physics #Scaling #Statistical physics #Thermodynamics #Transformer #Video Analysis and Summarization #Voltage
14. Practical and Scalable Hamiltonian Monte Carlo Without the Metropolis Test
    2024/12/12 by Jakob Robnik, Robnik, Jakob, Cohn-Gordon, Reuben +1 · 2 citations
    Mathematics · Physics and Astronomy · #Computation (stat.CO) #Cosmology and Nongalactic Astrophysics (astro-ph.CO) #FOS: Computer and information sciences #FOS: Physical sciences #Hamiltonian (control theory) #Hybrid Monte Carlo #Markov Chains and Monte Carlo Methods #Markov chain Monte Carlo #Mathematical optimization #Mathematics #Monte Carlo method #Physics #Statistical Mechanics and Entropy #Statistical physics #Statistics #Theoretical and Computational Physics
15. Supernovae evidence for foundational change to cosmological models
    2024/11/28 by Antonia Seifert, Zachary G. Lane, Marco Galoppo +2 · 12 voices · 5 citations
    Physics and Astronomy · #Astrophysics #Cosmology #Cosmology and Gravitation Theories #Dark energy #Galaxies: Formation, Evolution, Phenomena #Galaxy #Gamma-ray bursts and supernovae #Homogeneity (statistics) #Homogeneous #Isotropy #Lambda #Lambda-CDM model #Physics #Quantum mechanics #Redshift #Statistical physics #Statistics #Supernova #Theoretical physics
16. The Limits of Inference Scaling Through Resampling
    2024/11/26 by Benedikt Stroebl, Sayash Kapoor, Stroebl, Benedikt +3 · 2 voices · 32 citations
    Computer Science · Mathematics · #Artificial intelligence #Computer science #Econometrics #Geometry #Imperfect #Inference #Machine learning #Mathematics #Natural Language Processing Techniques #Physics #Resampling #Scaling #Statistical physics #Topic Modeling
17. Mixed-State Quantum Denoising Diffusion Probabilistic Model
    2024/11/26 by Gino Kwun, Kwun, Gino, Bingzhi Zhang +3 · 6 citations
    Computer Science · Engineering · #Algorithm #Artificial Intelligence (cs.AI) #Artificial intelligence #Computational Physics and Python Applications #Computer science #Diffusion #FOS: Computer and information sciences #FOS: Physical sciences #Machine Learning (cs.LG) #Neural Networks and Applications #Noise reduction #Physics #Probabilistic logic #Quantum #Quantum Physics (quant-ph) #Quantum mechanics #Smart Grid and Power Systems #State (computer science) #Statistical physics
18. Real-time scattering in Ising field theory using matrix product states
    2024/11/20 by Raghav G. Jha, Jha, Raghav G., Ashley Milsted +7 · 3 voices · 16 citations
    Mathematics · Physics and Astronomy · #Complex Network Analysis Techniques #Field (mathematics) #Geometry #Ising model #Materials science #Mathematics #Matrix (chemical analysis) #Opinion Dynamics and Social Influence #Physics #Product (mathematics) #Pure mathematics #Quantum electrodynamics #Quantum mechanics #S-matrix #Scattering #Statistical physics #Theoretical and Computational Physics
19. On Estimating the Trace of Quantum State Powers
    2024/10/17 by Yupan Liu, Liu, Yupan, Qisheng Wang +1 · 9 citations
    Computer Science · Physics and Astronomy · #Algorithm #Computational complexity theory #Computer science #Environmental science #Joint quantum entropy #Philosophy #Physics #Quantum #Quantum Computing Algorithms and Architecture #Quantum Information and Cryptography #Quantum Mechanics and Applications #Quantum algorithm #Quantum mechanics #Quantum mutual information #Quantum phase estimation algorithm #Quantum relative entropy #Quantum state #Qubit #State (computer science) #Statistical physics #TRACE (psycholinguistics) #Von Neumann entropy
20. The bulk one‐arm exponent for the CLE κ′ percolations
    2024/10/16 by Haoyu Liu, Liu, Haoyu, Xin Sun +8 · 2 citations
    Mathematics · Physics and Astronomy · #Chiral Potts curve #Conformal field theory #Conformal map #Critical exponent #Exponent #Gaussian free field #Geometry #Kappa #Linguistics #Mathematics #Philosophy #Physics #Potts model #Random Matrices and Applications #Scaling #Scaling limit #Statistical physics #Stochastic processes and statistical mechanics #Theoretical and Computational Physics
21. Brownian Motion in Isabelle/HOL
    2024/10/13 by Christian Pardillo Laursen, Laursen, Christian Pardillo, Simon Foster +3 · 1 citation
    Mathematics · #Brownian motion #Classical mechanics #Computer science #FOS: Computer and information sciences #HOL #Logic in Computer Science (cs.LO) #Markov Chains and Monte Carlo Methods #Mathematics #Motion (physics) #Physics #Programming language #Statistical physics #Statistics
22. Gibbs state preparation for commuting Hamiltonian: Mapping to classical Gibbs sampling
    2024/10/07 by Yeongwoo Hwang, Hwang, Yeongwoo, Jiaqing Jiang +1 · 3 citations
    Computer Science · Mathematics · Physics and Astronomy · #Advanced Thermodynamics and Statistical Mechanics #Bayesian probability #Computer science #Gibbs sampling #Gibbs state #Hamiltonian (control theory) #Markov Chains and Monte Carlo Methods #Mathematical economics #Mathematical optimization #Mathematics #Physics #Quantum mechanics #Sampling (signal processing) #Statistical Mechanics and Entropy #Statistical physics #Statistics #cs.CC #cs.DS #quant-ph
23. Time-Lagged Recurrence: a data-driven method to estimate the predictability of dynamical systems
    2024/09/23 by Chenyu Dong, Davide Faranda, Adriano Gualandi +2 · 1 voice · 3 citations
    Computer Science · Economics, Econometrics and Finance · Environmental Science · Mathematics · #Artificial intelligence #Chaotic #Climate variability and models #Complex Systems and Time Series Analysis #Computer science #Data science #Dynamical system (definition) #Dynamical systems theory #Econometrics #Ecosystem dynamics and resilience #Lyapunov exponent #Mathematics #Nonlinear dynamical systems #Nonlinear system #Operator (biology) #Physics #Predictability #Recurrence quantification analysis #Representation (politics) #Scale (ratio) #Statistical physics #Statistics #Time Series Analysis and Forecasting #Weighting
24. Eco-Evolutionary Dynamics for Finite Populations and the Noise-Induced Reversal of Selection
    2024/09/18 by Ananda Shikhara Bhat, Vishwesha Guttal · 4 citations
    Biochemistry, Genetics and Molecular Biology · Medicine · Social Sciences · #Acoustics #Artificial intelligence #Biological system #Biology #Computer science #Demography #Dynamics (music) #Ecology #Evolution and Genetic Dynamics #Evolutionary Game Theory and Cooperation #Evolutionary biology #Evolutionary dynamics #Frequency-dependent selection #Mathematical and Theoretical Epidemiology and Ecology Models #Noise (video) #Physics #Population #Selection (genetic algorithm) #Statistical physics
25. What is Entropy?
    2024/09/13 by John C. Baez, Baez, John C. · 7 voices
    Engineering · Environmental Science · Mathematics · Physics and Astronomy · #Advanced Thermodynamics and Statistical Mechanics #Econometrics #Economics #Fluid dynamics and aerodynamics studies #Mathematics #Physics #Science and Climate Studies #Statistical physics #cond-mat.stat-mech #math-ph
26. Correlated quantum machines beyond the standard second law
    2024/09/12 by Milton Aguilar, Aguilar, Milton, Eric Lutz +1 · 6 citations
    Computer Science · Physics and Astronomy · #Economics #FOS: Physical sciences #Law #Law and economics #Physics #Political science #Quantum #Quantum Computing Algorithms and Architecture #Quantum Information and Cryptography #Quantum Mechanics and Applications #Quantum Physics (quant-ph) #Quantum mechanics #Statistical Mechanics (cond-mat.stat-mech) #Statistical physics #Theoretical physics
27. Absorption Intensities of Organic Molecules from Electronic Structure Calculations versus Experiments: the Effect of Solvation, Method, Basis Set, and Transition Moment Gauge
    2024/08/14 by Jorge C. Garcia-Alvarez, Samer Gozem · 1 voice
    Physics and Astronomy · Chemistry · Mathematics · #Spectroscopy and Quantum Chemical Studies #Photochemistry and Electron Transfer Studies #Advanced Chemical Physics Studies #Solvation #Basis set #Moment (physics) #Basis (linear algebra) #Gauge (firearms) #Set (abstract data type) #Chemical physics #Molecule #Organic molecules #Computational chemistry #Absorption (acoustics) #Chemistry #Electronic structure #Statistical physics #Materials science #Molecular physics #Atomic physics #Physics #Computer science #Quantum mechanics #Mathematics #Organic chemistry
28. Randomness versus Nonlocality in Multi-input and Multi-output Quantum Scenario
    2024/08/08 by Chao Zhang, Yi Li, Zhang, Chao +17 · 2 citations
    Computer Science · Mathematics · Physics and Astronomy · #Computer science #FOS: Physical sciences #Mathematics #Physics #Quantum #Quantum Computing Algorithms and Architecture #Quantum Information and Cryptography #Quantum Mechanics and Applications #Quantum Physics (quant-ph) #Quantum entanglement #Quantum mechanics #Quantum nonlocality #Randomness #Statistical physics #Statistics
29. Black holes and covariance in effective quantum gravity
    2024/07/31 by Cong Zhang, Jerzy Lewandowski, Yongge Ma +1 · 15 citations
    Mathematics · Physics and Astronomy · #Black Holes and Theoretical Physics #Classical mechanics #Cosmology and Gravitation Theories #Covariance #Mathematics #Noncommutative and Quantum Gravity Theories #Physics #Quantum #Quantum gravity #Quantum mechanics #Statistical physics #Statistics #Theoretical physics
30. Generalised BBGKY hierarchy for near-integrable dynamics
    2024/08/01 by Leonardo Biagetti, Maciej Łebek, Maciej Lebek +7 · 3 citations
    Mathematics · Physics and Astronomy · #BBGKY hierarchy #Distribution function #Dynamics (music) #Econometrics #Economics #Hierarchy #Integrable system #Mathematical physics #Mathematics #Nonlinear Waves and Solitons #Numerical methods for differential equations #Physics #Quantum chaos and dynamical systems #Statistical physics #Thermodynamics #cond-mat.quant-gas #cond-mat.stat-mech #nlin.SI

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