zhaoqy1996

Delta2ML

Delta^2 ML model that takes GFN2-xTB level geometries and energies to provide DFT and G4-level energy prediction.

generative-ai-for-beginners

18 Lessons, Get Started Building with Generative AI 🔗 https://microsoft.github.io/generative-ai-for-beginners/

ord-schema

Schema for the Open Reaction Database

pyGSM

Thermal and photochemical reaction path optimization and discovery

RGD1

A large reaction database obtained by comprehensive exploring graphically defined reaction spaces

TCIT-Hf

Taffi component increment theory used to predict enthalpy of formation

TCIT_thermo

Taffi component increment theory used to predict enthalpy of formation, standard entropy and heat capacity.

webpage

A personal resume website template built with React.js, Typescript, Next.js, and styled with Tailwind css

YARP

zhaoqy1996.github.io

Github Pages template for academic personal websites, forked from mmistakes/minimal-mistakes

zhaoqy1996/YARP

zhaoqy1996/Delta2ML

Delta^2 ML model that takes GFN2-xTB level geometries and energies to provide DFT and G4-level energy prediction.

zhaoqy1996/TCIT_thermo

Taffi component increment theory used to predict enthalpy of formation, standard entropy and heat capacity.

zhaoqy1996/RGD1

A large reaction database obtained by comprehensive exploring graphically defined reaction spaces

zhaoqy1996/generative-ai-for-beginners

18 Lessons, Get Started Building with Generative AI 🔗 https://microsoft.github.io/generative-ai-for-beginners/

zhaoqy1996/ord-schema

Schema for the Open Reaction Database

zhaoqy1996/pyGSM

Thermal and photochemical reaction path optimization and discovery

zhaoqy1996/TCIT-Hf

Taffi component increment theory used to predict enthalpy of formation

zhaoqy1996/webpage

A personal resume website template built with React.js, Typescript, Next.js, and styled with Tailwind css

zhaoqy1996/zhaoqy1996.github.io

Github Pages template for academic personal websites, forked from mmistakes/minimal-mistakes