Related Issues (20)
- double free or corruption (!prev) or corrupted double-linked list in the end of scf calculation HOT 10
- Interface with abacustest developer package for higher automatility HOT 1
- Error due to symmetry in a simple test case HOT 14
- Bugs: Different SCF with equivalent `STRU` HOT 6
- Error when use mpi in docker environment.
- Error when using bohrium B series GPU. HOT 6
- DCU calculation error HOT 2
- Compilation error when using the USE_ROCM=on flag. HOT 1
- Inner loop of DeltaSpin is confusing HOT 1
- assert(psi_norm>0) error with ks_solver dav HOT 9
- No error given if target_mag_val is not set in sc.json file
- No warning given if KPT is ill set HOT 3
- Set the initial magnetic moments for elements in the INPUT file
- CMake encounters a `Maximum recursion depth of 1000 exceeded` error when compiling with Clang and the ROCm environment. HOT 2
- abacus-plot HOT 7
- Convergence Problem HOT 8
- Refactoring & Optimization: Removal of GlobalC::UOT and GlobalC::ORB
- SCF is hard to converge for La series elements HOT 1
- Need to get rid of some module dependence in `nbands_istate`
Recommend Projects
-
React
A declarative, efficient, and flexible JavaScript library for building user interfaces.
-
Vue.js
🖖 Vue.js is a progressive, incrementally-adoptable JavaScript framework for building UI on the web.
-
Typescript
TypeScript is a superset of JavaScript that compiles to clean JavaScript output.
-
TensorFlow
An Open Source Machine Learning Framework for Everyone
-
Django
The Web framework for perfectionists with deadlines.
-
Laravel
A PHP framework for web artisans
-
D3
Bring data to life with SVG, Canvas and HTML. 📊📈🎉
-
Recommend Topics
-
javascript
JavaScript (JS) is a lightweight interpreted programming language with first-class functions.
-
web
Some thing interesting about web. New door for the world.
-
server
A server is a program made to process requests and deliver data to clients.
-
Machine learning
Machine learning is a way of modeling and interpreting data that allows a piece of software to respond intelligently.
-
Visualization
Some thing interesting about visualization, use data art
-
Game
Some thing interesting about game, make everyone happy.
Recommend Org
-
Facebook
We are working to build community through open source technology. NB: members must have two-factor auth.
-
Microsoft
Open source projects and samples from Microsoft.
-
Google
Google ❤️ Open Source for everyone.
-
Alibaba
Alibaba Open Source for everyone
-
D3
Data-Driven Documents codes.
-
Tencent
China tencent open source team.
from abacus-develop.