Uncategorized
| Topic | Replies | Views | Activity | |
|---|---|---|---|---|
|
Open Catalyst Intro Series
We’re excited to announce the Open Catalyst Intro Series! Want to learn more about how we can help mitigate climate change through advances in AI and chemistry? We’re creating a video series to help AI researchers get up… |
|
2 | 628 | January 15, 2024 |
|
OCP Colab Tutorial
Hi All, As part of our recent NeurIPS 2021 Climate Change AI Workshop submission, we’ve released a more comprehensive, interactive google colab notebook here to accompany our other notebooks here. The notebook is design… |
|
1 | 813 | January 11, 2022 |
|
Welcome to Discourse
|
|
3 | 2064 | June 17, 2021 |
|
IS2RS of OC20 test extension request
|
|
0 | 9 | December 14, 2024 |
|
Using GemNet versions and LMDB files
|
|
2 | 77 | December 13, 2024 |
|
Offline benchmark code for OC22 leaderboard
|
|
1 | 17 | December 13, 2024 |
|
OCPCalculator a2g does not use edge nor distance information
|
|
1 | 10 | December 13, 2024 |
|
Nosé–Hoover MD calculation by OCPcalculator
|
|
2 | 501 | November 28, 2024 |
|
Open Catalyst eval server for leaderboard down
|
|
2 | 30 | November 25, 2024 |
|
Using OC22 Dataset for VASP Input File Generation
|
|
1 | 20 | November 25, 2024 |
|
'RuntimeError' Failed to find the mode ...l
|
|
1 | 21 | November 25, 2024 |
|
Parallel inference on 2 GPUs
|
|
1 | 14 | November 25, 2024 |
|
Molecular calculation with OCP-calculator
|
|
6 | 964 | November 25, 2024 |
|
Cannot set up environment
|
|
1 | 28 | November 25, 2024 |
|
CO adsorbate configurations
|
|
2 | 680 | November 21, 2024 |
|
Can not use pre-trianed model trianed on OC22 (+OC20)
|
|
1 | 50 | November 6, 2024 |
|
Divergent Training Behavior with EquiformerV2 on ANI-2x Dataset with PBC
|
|
2 | 20 | October 30, 2024 |
|
Is OC20 adsorption energy unit eV or meV?
|
|
5 | 33 | October 30, 2024 |
|
OMAT24 Cell optimization
|
|
1 | 37 | October 30, 2024 |
|
Questions on OCPNEB calculator used in CatTSunami
|
|
6 | 38 | October 29, 2024 |
|
Why is there no IS2RS in OC22 leadborad?
|
|
0 | 12 | October 28, 2024 |
|
Question about energy of OC20 dataset
|
|
2 | 207 | October 28, 2024 |
|
OMAT24 database read
|
|
1 | 115 | October 21, 2024 |
|
[OCP-demo] adslab filter for shift value
|
|
0 | 24 | September 27, 2024 |
|
Reading the adsorbates in OC22 dataset
|
|
2 | 46 | September 27, 2024 |
|
Datasets for alloys
|
|
0 | 43 | September 17, 2024 |
|
Visualization techniques
|
|
1 | 39 | August 30, 2024 |
|
AdsorbML tutorial: Can't import OCPCalculator
|
|
1 | 35 | August 16, 2024 |
|
Inquiry about obtaining bulk structures for non-standard Bulk IDs in OC22 Dataset
|
|
2 | 40 | August 14, 2024 |
|
AdsorbML clarifications
|
|
1 | 53 | August 5, 2024 |