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google-deepmind
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ferminet
An implementation of the Fermionic Neural Network for ab-initio electronic structure calculations
Apache License 2.0
721
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120
forks
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AttributeError: module 'kfac_jax._src.utils' has no attribute 'Array'
#81
weizd
opened
3 hours ago
1
Model parameters being marked as orphan when using KFAC optimizer
#80
Uernd
closed
43 minutes ago
1
pin folx version
#79
Ruturaj4
opened
2 weeks ago
1
Program stuck in somewhere
#78
whopezx
closed
2 weeks ago
2
ferminet.network do not have fermi_net function
#77
FXTY
closed
2 weeks ago
1
Natural Excited States to nan
#76
KingDamLiu
closed
2 weeks ago
2
Use fully qualified names for pylint overgeneral-exceptions
#75
halvarsu
closed
1 month ago
0
Logdet Bug Similar to e9f8c64
#74
mrlazy1708
closed
5 months ago
1
KeyError raised after burn-in MCMC steps
#73
Yangcn1995
closed
5 months ago
1
Sample orbitals
#72
nilin
closed
8 months ago
2
Update call to `psd_inv_cholesky` to fix breaking change
#71
gcassella
closed
10 months ago
4
Upstream breaking change in `kfac-jax`
#70
gcassella
closed
10 months ago
0
kfac_jax error when running H2 example script
#69
eliasteve
closed
11 months ago
2
Different results obtained from the paper for ch3nh2
#68
lamthuy
closed
1 year ago
2
Something went wrong in RepeatedDenseBlock.update_curvature_matrix_estimate
#67
JustusvLiebig
closed
1 year ago
2
Update supported python versions in github CI workflow
#66
jsspencer
closed
1 year ago
0
Remove atoms from MakeLocalEnergy protocol
#65
halvarsu
closed
1 year ago
0
Adding WQMC objective option
#64
necludov
closed
1 year ago
3
Extension of PBC code to 1D
#63
eliasteve
closed
10 months ago
7
Issue on running pytest
#62
SLZ0106
closed
1 year ago
5
Evaluating logprob using batch_network in train
#61
Baiyu-Su
closed
1 year ago
1
Question About load Checkpoint
#60
ZiciuCanJustus
closed
1 year ago
1
About configs
#59
qetuo2
closed
1 year ago
3
fix: the bug of `make_feature_layer` input
#58
wanghan-iapcm
closed
1 year ago
2
nan when training with 'adam'
#57
lzx0106
closed
1 year ago
1
Allow variable ndim
#56
halvarsu
closed
2 years ago
0
Initialization policy for charged molecules
#55
shaipranesh2
closed
1 year ago
4
Fix inverted conditional in pbc.feature_layer
#54
gcassella
closed
2 years ago
0
Remove deprecated kfac_jax kwarg
#53
gcassella
closed
2 years ago
1
Question about pbc ewald part.
#52
GiantElephant123
closed
2 years ago
2
Ground State Energies
#51
EyalRozenberg1
closed
2 years ago
2
replacing format with fstring for better code readability
#50
himalayanZephyr
closed
2 years ago
2
Implement calculations in periodic boundary conditions
#49
gcassella
closed
2 years ago
1
Tf
#48
ChignoliPaolo
closed
2 years ago
2
The proper way to cite FermiNet repo
#47
connection-on-fiber-bundles
closed
2 years ago
1
unable to setup
#46
aigexiansheng
closed
2 years ago
1
Jax error running on A100 GPU (everything is okay on CPU)
#45
ltz0120
closed
2 years ago
2
AttributeError: module 'jax.core' has no attribute 'extract_call_jaxpr'
#44
draxelsen
closed
2 years ago
1
Jax install - issue with correct version number
#43
Dehavendrew
closed
2 years ago
1
Use unused mcmc_width parameter
#42
halvarsu
closed
2 years ago
0
How does training time scale w.r.t. model size?
#41
haydnv
closed
2 years ago
1
Fix code comment errors in the Jax implementation.
#40
shishaochen
closed
2 years ago
1
Installation Error
#39
ghost
closed
2 years ago
7
Question about exact_cusp function
#38
ley61
closed
2 years ago
1
about the ferminet
#37
KingDamLiu
closed
2 years ago
2
install eeror
#36
KingDamLiu
closed
2 years ago
3
Alter codebase to allow cfg.system.ndim =/= 3
#35
gcassella
closed
2 years ago
2
How to reproduce the results for Neon. JAX.
#34
ghost
closed
3 years ago
3
how to make JAX code run on single GPU instead of TPU?
#33
ghost
closed
3 years ago
2
ValueError: Using default_file_mode other than 'r' is no longer supported. Pass the mode to h5py.File() instead. JAX branch.
#32
ghost
closed
3 years ago
1
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