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Formation Energy on
OQM9HK
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MAE
낮을수록 좋음
0.03433
0.1032
0.1722
0.2411
0.31
2017-06
2026-09
SchNet — 0.31 (2017-06-26)
SchNet — 0.31 (2017-06-26)
CGNN Full Ensemble — 0.03433 (2022-09-30)
CGNN Trio Ensemble — 0.03658 (2022-09-30)
CGNN — 0.04249 (2022-09-30)
CGNN Full Ensemble — 0.03433 (2022-09-30)
CGNN Trio Ensemble — 0.03658 (2022-09-30)
CGNN — 0.04249 (2022-09-30)
SchNet — 0.31 (2017-06-26)
CGNN Full Ensemble — 0.03433 (2022-09-30)
2017-06-26 — SchNet: MAE 0.31
2022-09-30 — CGNN Full Ensemble: MAE 0.03433
Rank
Model
MAE
Paper
Code
Year
1
CGNN Full Ensemble
0.03433
OQM9HK: A Large-Scale Graph Dataset for Machine Learning in Materials Science
Tony-Y/cgnn
2022
2
CGNN Trio Ensemble
0.03658
OQM9HK: A Large-Scale Graph Dataset for Machine Learning in Materials Science
Tony-Y/cgnn
2022
3
CGNN
0.04249 ± 0.00037
OQM9HK: A Large-Scale Graph Dataset for Machine Learning in Materials Science
Tony-Y/cgnn
2022
4
SchNet
0.31
SchNet: A continuous-filter convolutional neural network for modeling quantum interactions
atomistic-machine-learning/schnetpack
·
atomistic-machine-learning/SchNet
·
xiuyu0000/new_papers_codes
·
+2
2017
5
CGNN Full Ensemble
0.03433
OQM9HK: A Large-Scale Graph Dataset for Machine Learning in Materials Science
Tony-Y/cgnn
2022
6
CGNN Trio Ensemble
0.03658
OQM9HK: A Large-Scale Graph Dataset for Machine Learning in Materials Science
Tony-Y/cgnn
2022
7
CGNN
0.04249 ± 0.00037
OQM9HK: A Large-Scale Graph Dataset for Machine Learning in Materials Science
Tony-Y/cgnn
2022
8
SchNet
0.31
SchNet: A continuous-filter convolutional neural network for modeling quantum interactions
atomistic-machine-learning/schnetpack
·
atomistic-machine-learning/SchNet
·
xiuyu0000/new_papers_codes
·
+2
2017
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