From d78c37d6aee3dc2d2e6977c3c8da99b2bafb15b6 Mon Sep 17 00:00:00 2001 From: Shyue Ping Ong Date: Fri, 28 Jul 2023 07:38:48 -0700 Subject: [PATCH] Update all M3Gnet model versino numbers to 2 due to recent change of set2set in init. No effect on PES models, just EForm models. --- matgl/models/_m3gnet.py | 2 +- .../M3GNet-MP-2018.6.1-Eform/model.json | 2 +- .../M3GNet-MP-2018.6.1-Eform/model.pt | Bin 2535 -> 2527 bytes .../M3GNet-MP-2021.2.8-DIRECT-PES/model.json | 2 +- .../M3GNet-MP-2021.2.8-DIRECT-PES/model.pt | Bin 3685 -> 3685 bytes .../M3GNet-MP-2021.2.8-PES/model.json | 2 +- .../M3GNet-MP-2021.2.8-PES/model.pt | Bin 3743 -> 3743 bytes 7 files changed, 4 insertions(+), 4 deletions(-) diff --git a/matgl/models/_m3gnet.py b/matgl/models/_m3gnet.py index 34a7ad41..494346c8 100644 --- a/matgl/models/_m3gnet.py +++ b/matgl/models/_m3gnet.py @@ -49,7 +49,7 @@ class M3GNet(nn.Module, IOMixIn): """The main M3GNet model.""" - __version__ = 1 + __version__ = 2 def __init__( self, diff --git a/pretrained_models/M3GNet-MP-2018.6.1-Eform/model.json b/pretrained_models/M3GNet-MP-2018.6.1-Eform/model.json index 9936aa92..fbdd3737 100644 --- a/pretrained_models/M3GNet-MP-2018.6.1-Eform/model.json +++ b/pretrained_models/M3GNet-MP-2018.6.1-Eform/model.json @@ -7,7 +7,7 @@ "model": { "@class": "M3GNet", "@module": "matgl.models._m3gnet", - "@model_version": 1, + "@model_version": 2, "init_args": { "element_types": [ "H", diff --git a/pretrained_models/M3GNet-MP-2018.6.1-Eform/model.pt b/pretrained_models/M3GNet-MP-2018.6.1-Eform/model.pt index e1439809bbd9ba91dc3b68507cfb578456cac78c..2351011b936e3c0808ad84de6519f65002a56447 100644 GIT binary patch delta 315 zcmaDZd|!Bilms7x2t#guN@|XNN@7W(UO{$_o09-TRMbSHT1KXg8;aR@t{dgtyU)hJ z0KyZbM0gm~ku>NVxH%~^OuopjJh_2g4=Cw`ENSTGWCxPepIpGsKZ!$6l$XH~Dqogb zRGgWg=jLP!Q@}U5fkR0d*)~1~bO3hgNCkMa0)5TEzygG?f%GJxdIkmnGABem delta 316 zcmcaF{9Jf~l!O3-5JO^7azQr4|)u=I6ON zSp#KlCO2>>sUlk=z<>^*PMmy{LsgOwMN*%g0cPxEMowik*(pe})<9W)6ulxG2)(78 f29lqlvXg+~AQ0fq2Gq~M&^mb^r#Kf#79s-xAOc0K diff --git a/pretrained_models/M3GNet-MP-2021.2.8-DIRECT-PES/model.json b/pretrained_models/M3GNet-MP-2021.2.8-DIRECT-PES/model.json index 9332650b..1f146d80 100644 --- a/pretrained_models/M3GNet-MP-2021.2.8-DIRECT-PES/model.json +++ b/pretrained_models/M3GNet-MP-2021.2.8-DIRECT-PES/model.json @@ -7,7 +7,7 @@ "model": { "@class": "M3GNet", "@module": "matgl.models._m3gnet", - "@model_version": 1, + "@model_version": 2, "init_args": { "element_types": [ "H", diff --git a/pretrained_models/M3GNet-MP-2021.2.8-DIRECT-PES/model.pt b/pretrained_models/M3GNet-MP-2021.2.8-DIRECT-PES/model.pt index 16c04ca934572bb58a65cba93031f674791510a3..cac2754a008a943a07ae117738be350b250519cd 100644 GIT binary patch delta 88 zcmaDV^HgTSdPb&=8;-EDGczzSBo~x!u47|lG4cwgA87A-KS;+}kH#wWvm$7^DPTn;DL_8R5 diff --git a/pretrained_models/M3GNet-MP-2021.2.8-PES/model.json b/pretrained_models/M3GNet-MP-2021.2.8-PES/model.json index 2511d572..4adf89ff 100644 --- a/pretrained_models/M3GNet-MP-2021.2.8-PES/model.json +++ b/pretrained_models/M3GNet-MP-2021.2.8-PES/model.json @@ -7,7 +7,7 @@ "model": { "@class": "M3GNet", "@module": "matgl.models._m3gnet", - "@model_version": 1, + "@model_version": 2, "init_args": { "element_types": [ "H", diff --git a/pretrained_models/M3GNet-MP-2021.2.8-PES/model.pt b/pretrained_models/M3GNet-MP-2021.2.8-PES/model.pt index 1f8b8c5dbd2e09f52853402151ed21b6a875cce4..90396d2652b790089e67b3cf518cf27f0044eb47 100644 GIT binary patch delta 195 zcmbO)J70FgZ8nPtJ_ZH`hur*>)SURT)S}|d{Jg@+-b|$toIvrE#FE7L+|4ror9w-x;2Z7fgx-10xo$$83wRR^g$Nu8@M@1OkT(%xrsZ8i4&nNo7b0d J*W{hN&j2OQJ~IFS delta 200 zcmbO)J70FgZ8nF}2u=nDhLpsT#Q5CQ#Js}Eei0lnf#Q;s!YS_dH{KinymvA>f(Iy` znv~K zCeZkqlP7SAiq7(8EY%C}X6Lx|Q@ARai-7@zCrAnNFc>rB=BK3Q=z|=jZ{X&nKY1aK b{A2}Q!A;yrOq_7#le2k!85d99$@>fd0Hs1l