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siesta-project
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flos
Interfacing SIESTA to Lua scripts using the flook code
https://siesta-project.github.io/flos/index.html
MIT License
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run lua on single cpu
#16
mgoonde
closed
1 year ago
1
Add new example with configurable NEB script
#15
albgar
closed
1 year ago
1
Update middleclass submodule
#14
albgar
closed
1 year ago
1
Allow chemical symbols in xyz files in the NEB driver
#13
albgar
closed
3 years ago
0
Implement a mechanism for setting script variables
#12
albgar
closed
1 year ago
5
Dynamic Relaxation for siesta/flos NEB calculation
#11
rezabma
opened
3 years ago
3
Question: Can flos be used to manage the transiesta scf cycle?
#10
pfebrer
closed
3 years ago
10
Merging
#9
arsalan-akhtar
opened
3 years ago
1
interpolation error
#8
rezabma
opened
5 years ago
0
empty middleclass
#7
rezabma
closed
5 years ago
1
Idea proposed #2
#6
rezabma
opened
5 years ago
5
Idea proposed #1
#5
rezabma
opened
5 years ago
7
Instruction for SIESTA arch.make incoplete
#4
fedmar
closed
6 years ago
0
Wrote rockspec for flos 0.1
#3
pouillon
closed
7 years ago
3
Enable a SIESTA function for each of the classes
#2
zerothi
closed
7 years ago
0
New array data-type
#1
zerothi
closed
7 years ago
0