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arXiv research

A locally-built, LLM-digested index of recent arXiv papers in quant finance, geometry/topology, and statistical ML — keyword search served straight from SQLite on this machine.

168,695 papers · 148 categories

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83167250333 · Jun 202019922001200920172026
48 results for electronic systems

Develops methods to learn correlation potentials for time-dependent Kohn-Sham systems.

problem Learning the correlation potential for time-dependent Kohn-Sham systems.
method Optimizing a least-squares objective subject to the TDKS equation using adjoints.
result Learned correlation potential models match ground truth electron densities and can have memory.

[New and updated results were published in Nature Chemistry, doi:10.1038/s41557-020-0544-y.] The electronic Schrödinger equation describes fundamental properties of molecules and materials, but can only be solved analytically for the hydrogen atom. The numerically exact full configuration-interaction method is exponent…

2019-09-16abs ↗pdf ↗

Learning from data has led to a paradigm shift in computational materials science. In particular, it has been shown that neural networks can learn the potential energy surface and interatomic forces through examples, thus bypassing the computationally expensive density functional theory calculations. Combining many-bod…

2018-10-04abs ↗pdf ↗

This paper presents the results of an automated volatile organic compound (VOC) classification process implemented by embedding a machine learning algorithm into an Arduino Uno board. An electronic nose prototype is constructed to detect VOCs from three different fruits. The electronic nose is constructed using an arra…

2019-05-15abs ↗pdf ↗

Cardea automates machine learning for EHRs, improving model building efficiency.

problem Lack of a trusted, open-source framework for automated machine learning in EHRs.
method Uses FHIR for data structure, AUTOML frameworks for feature engineering, model selection, and tuning, and an adaptive data assembler.
result Demonstrates framework's effectiveness on 5 prediction tasks, highlighting its flexibility and human competitiveness.

AI predicts medical specialty diagnostic choices from EHR records.

problem Predicting timely medical specialty diagnostic workups for patients.
method Ensemble of feed-forward neural networks trained on EHR data.
result Significantly higher accuracy compared to traditional checklists.

New method trains deep neural networks for non-interacting kinetic-energy functionals in DFT.

problem Lack of exact relationship between electron density and non-interacting kinetic energy.
method Variational principle to regularize machine-learned density functionals.
result Excellent results on kinetic-energy functionals for various systems.

ARX models predict thermal behavior of WBG semiconductors accurately.

problem Thermal management challenges of WBG semiconductors.
method Use of ARX parametric models based on experimental measurements.
result ARX models provide accurate temperature predictions without detailed component information.

New model predicts molecular wavefunctions and densities with unprecedented accuracy.

problem Challenging task of predicting wavefunctions due to molecular rotations.
method Introduces SE(3)-equivariant operations for deep learning.
result Achieves speedups and error reductions over ab initio methods.

Data-driven approach discovers molecular photoswitches with separated electronic absorption bands.

problem Engineering photoswitchable molecules with specific electronic absorption bands remains challenging.
method Data-driven discovery pipeline using Gaussian processes for multitask learning.
result Multioutput Gaussian process (MOGP) trained on four photoswitch transition wavelengths outperforms single-task models and TD-DFT.

The Hamilton-Jacobi problem is revisited bearing in mind the consequences arising from a possible bi-Hamiltonian structure. The problem is formulated on the tangent bundle for Lagrangian systems in order to avoid the bias of the existence of a natural symplectic structure on the cotangent bundle. First it is developed …

2006-04-26abs ↗pdf ↗

Study on electronic banking satisfaction in Nigeria.

problem Limited research on factors enhancing end users' satisfaction in electronic banking.
method Empirical analysis of factors influencing electronic banking user satisfaction.
result Factors influencing electronic banking user satisfaction and their relationship with satisfaction.

PEHRT harmonizes EHR data for translational research.

problem Barriers in using EHR data for translational research.
method Common pipeline including open-source code, visualization tools, and detailed documentation.
result PEHRT harmonizes EHR data to standardized ontologies and generates robust embeddings.

Molecular dynamics simulations are an important tool for describing the evolution of a chemical system with time. However, these simulations are inherently held back either by the prohibitive cost of accurate electronic structure theory computations or the limited accuracy of classical empirical force fields. Machine l…

2018-12-18abs ↗pdf ↗

Machine learning constructs problem-based medical records from electronic health records.

problem Difficulty in finding relevant medical information for clinical questions.
method Knowledge base completion using machine learning on electronic health records.
result Automatic construction of problem-based groupings of medications, procedures, and lab tests.

Method learns molecular Hamiltonian for accurate electron dynamics predictions.

problem Predict electron dynamics in molecules using learned Hamiltonians.
method Combines linear statistical model with quantum Liouville equation time discretization.
result Predicted electron dynamics closely matches ground truth, even beyond training data.

DenSNet learns electron densities for molecular dynamics, enabling accurate spectroscopic predictions.

problem Lack of accurate electronic observables in MLIPs for molecular dynamics.
method DenSNet uses SE(3)-equivariant neural networks to predict electron densities and total energy.
result DenSNet predicts infrared spectra with excellent agreement to experimental data.

Agent-based model simulates speculative electronic market with price bubbles.

problem Understanding speculative behavior and price bubbles in electronic markets.
method Agent-based model with two types of traders: mean reverting and speculative.
result Speculative traders lead to increased volatility and price deviations from fundamental value.

This paper examines the intra-day seasonality of transacted limit and market orders in the DEM/USD foreign exchange market. Empirical analysis of completed transactions data based on the Dealing 2000-2 electronic inter-dealer broking system indicates significant evidence of intraday seasonality in returns and return vo…

2011-03-29abs ↗pdf ↗

Excited-state dynamics simulations are a powerful tool to investigate photo-induced reactions of molecules and materials and provide complementary information to experiments. Since the applicability of these simulation techniques is limited by the costs of the underlying electronic structure calculations, we develop an…

2019-12-18abs ↗pdf ↗

Machine learning predicts electronic density of states for condensed matter.

problem Predicting the electronic density of states (DOS) in complex condensed matter systems.
method Developed a machine learning framework to predict DOS from density functional theory data, considering geometric configurations of atoms.
result Demonstrated the model's effectiveness in predicting DOS and its components for various silicon configurations.

The Duffing oscillator's parameters are identified online using variational message passing.

problem Estimating parameters of a nonlinear Duffing oscillator in real-time.
method Variational message passing on a factor graph of the Duffing oscillator's generative model.
result The online inference procedure performs as well as offline methods.

Confidentiality of patient information is an essential part of Electronic Health Record System. Patient information, if exposed, can cause a serious damage to the privacy of individuals receiving healthcare. Hence it is important to remove such details from physician notes. A system is proposed which consists of a deep…

2018-08-03abs ↗pdf ↗

High Frequency Trading (HFT) represents an ever growing proportion of all financial transactions as most markets have now switched to electronic order book systems. The main goal of the paper is to propose continuous time equations which generalize the self-financing relationships of frictionless markets to electronic …

2013-12-09abs ↗pdf ↗

The use of machine learning systems to support decision making in healthcare raises questions as to what extent these systems may introduce or exacerbate disparities in care for historically underrepresented and mistreated groups, due to biases implicitly embedded in observational data in electronic health records. To …

2019-07-14abs ↗pdf ↗

Spectral analysis detects structural changes in financial networks.

problem Detecting structural transitions in financial networks to assess systemic risk.
method Ensemble properties of spectral radius of random graph models calibrated on real-world evolving networks.
result The spectral deviation captures ongoing topological changes in financial networks.

Equivariant graph neural networks predict electron density for molecules, liquids, and solids.

problem Predicting electron density for molecules, liquids, and solids using machine learning.
method Equivariant graph neural networks for predicting electron density at query points.
result The model predicts electron density with accuracy beyond state of the art and significantly faster than traditional DFT methods.

Recently, the notion of cryptocurrencies has come to the fore of public interest. These assets that exist only in electronic form, with no underlying value, offer the owners some protection from tracking or seizure by government or creditors. We model these assets from the perspective of asset flow equations developed …

2018-05-08abs ↗pdf ↗

A new method predicts electron density accurately from atom-centered models.

problem Predicting electron density accurately from atom-centered models.
method Gradient-based approach to minimize loss function in an optimized sparse feature space.
result Extremely accurate predictions of electron density and total energies.

New method identifies sepsis-related patient features in EMR data.

problem Identify sepsis-related patient features in EMR data.
method Linear multivariate Hawkes process model with ReLU link function, coupled with gradient-based method.
result Identifies several interpretable GC chains that precede sepsis.

We consider the Dirac equation in flat Minkowski 3-space and rewrite it as the Maxwell equation in Minkowski 4-space with torsion. The torsion tensor is defined as the dual of the electromagnetic vector potential. Our model clearly distinguishes the electron and the positron without resorting to "negative frequencies":…

2000-06-17abs ↗pdf ↗