A chemical and climate model of planetary atmospheres
An astrochemical network parser that supports multiple reaction network formats including KIDA, UDFA, PRIZMO, KROME, and UCLCHEM.
Web application to explore the QUEST database
Combining SchNet, PaiNN and SHARC – Bridging the Gap between Machine Learning and Photoinduced Dynamics
Antagonistic dual-wavelength TVAM reconstruction with examples and proof-of-principle simulations.
This app is for fitting Time Resolved Photoluminescence (TRPL) measurement data that includes the Instrument Response Function (IRF). It uses a reconvolution method to account for the IRF of the instrument system. It outputs fitting parameters and offers multiple lifetime decay models.
Self-auditing multi-agent mining of environmental photochemistry literature and kinetics modeling.
Bibliography of works by computational chemist Professor Peter J. Knowles (Cardiff University), covering quantum chemistry, electron correlation, and Molpro-related publications.
Automated application of Woodward-Fieser, Fieser and Fieser-Kuhn rules to predict absorption maxima of organic chromophores.
AI evaluation task in a synthetic photoredox reactor: interpret diagnostic readings and control flow, light, quenching and collection under shared resource limits.
Computational Data for the study of the photoisomerization mechanism of PAT
AI-powered botanical analysis tool using LangGraph and local Ollama (Llama3) for real-time phytochemical tracking and clinical report generation.
12-well cell culture plate irradiation setup with a 3D-printed case, with 808nm IR lasers and LM2596.
CDFD Part II: Origins of Life and Tri-Regime Bioenergetics
A python repository for quantitative analysis of excited state populations and more relevant to laser spectroscopy.
The Horiba Duetta fluorescence and absorbance spectrometer outputs data as .txt, which is not useful to anyone trying to do anything with this data. This program will convert the .txt file to .csv for analysis.
Warm-Neptune atmosphere study pairing a reproducible TESS transit fit with JWST context for sulfur dioxide and disequilibrium photochemistry, plus a source-graded review of molecular evidence.
Reproducible JWST/NIRISS audit of WASP-107 b: broad atmosphere spectrum, resolved helium triplet, and extended-thermosphere light curve.
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