Search found 2 matches
- Thu Nov 22, 2012 7:55 am
- Forum: Response calculations
- Topic: BigDFT, NEB calculation
- Replies: 0
- Views: 1966
BigDFT, NEB calculation
Hello! I am using BigDFT code, particularly NEB calculation. I tried to run files that are provided in the src/test/NEB directory of the package, but i can't reach the result that they received. Can somebody help me with input files? or can somebody explain me the full procedure of NEB run in BigDFT...
- Thu Nov 22, 2012 7:52 am
- Forum: Ground state
- Topic: BigDFT
- Replies: 0
- Views: 1492
BigDFT
Hello! I am using BigDFT code, particularly NEB calculation. I tried to run files that are provided in the src/test/NEB directory of the package, but i can't reach the result that they received. Can somebody help me with input files? or can somebody explain me the full procedure of NEB run in BigDFT...