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pnnl
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chemreasoner
ChemReasoner - Catalyst Discovery via Large Language Model-driven Reasoning
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Modified macrostructure planner
#34
HenrySprueill
closed
3 weeks ago
0
Updated README with instructions to run the ICML script successfully
#33
rounak-meyur
opened
2 months ago
0
Dft autoflow
#32
zhan051
closed
2 months ago
0
change ocp to forked version
#31
HenrySprueill
closed
3 months ago
0
Is the codebase currently runnable?
#30
DingYX0731
opened
3 months ago
2
How was LLM trained
#29
sherlockma11
opened
4 months ago
1
Coherent state
#28
HenrySprueill
closed
9 months ago
0
Coherent state
#27
HenrySprueill
closed
9 months ago
0
Coherent state
#26
HenrySprueill
closed
10 months ago
0
merge with tree answer parsing
#25
HenrySprueill
closed
10 months ago
0
Parallel llm
#24
HenrySprueill
closed
10 months ago
0
Merge with changes from master
#23
HenrySprueill
closed
10 months ago
0
merge with master
#22
HenrySprueill
closed
10 months ago
0
Coherent state
#21
HenrySprueill
closed
10 months ago
0
Coherent state
#20
HenrySprueill
closed
10 months ago
0
Coherent state
#19
HenrySprueill
closed
10 months ago
0
set num_samples to 10
#18
HenrySprueill
closed
10 months ago
0
add multi shot script
#17
HenrySprueill
closed
10 months ago
0
Coherent state
#16
HenrySprueill
closed
10 months ago
0
Coherent state
#15
HenrySprueill
closed
10 months ago
0
Coherent state
#14
HenrySprueill
closed
10 months ago
0
Coherent state
#13
HenrySprueill
closed
10 months ago
0
Coherent state
#12
HenrySprueill
closed
10 months ago
0
Coherent state
#11
HenrySprueill
closed
10 months ago
0
Coherent state
#10
HenrySprueill
closed
11 months ago
0
Changes to slab creation and the addition on reaction_reward.py
#9
gihanpanapitiya
closed
11 months ago
0
a fix for slab creation
#8
gihanpanapitiya
closed
11 months ago
0
Setup coherence test
#7
HenrySprueill
closed
11 months ago
0
Adding adsorbML options
#6
gihanpanapitiya
closed
11 months ago
0
change the tag setting to work better
#5
HenrySprueill
closed
11 months ago
0
Gnn unittest
#4
HenrySprueill
closed
11 months ago
0
Parallel llm
#3
HenrySprueill
closed
11 months ago
0
Parallel llm
#2
HenrySprueill
closed
11 months ago
0
Search traces are out of order.
#1
HenrySprueill
closed
10 months ago
0