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1)
Message boards :
Graphics cards (GPUs) :
5060 Ti not recognized on Linux Mint (all up to date). Suggestions?
(Message 62530)
Posted 26 Sep 2025 by Skip Da Shu Post: Mint (not LMDE) is always tied to the Ubuntu's most recent LTS release. |
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Message boards :
News :
PYSCFbeta: Quantum chemistry calculations on GPU
(Message 61502)
Posted 14 May 2024 by Skip Da Shu Post: Average error % rate as of early 5/7/24 using last 3 data scrapes - 5/14/24. 8:57am Zulu using last 3 data scrapes - AVG – last 3: 20.4 all cards 8GB – last 3: 25.22 (2x 3070) 10GB – last 3: 24.62 (2x 3080) 12GB – last 3: 2.11 (1x 4070S) Skip |
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Message boards :
News :
PYSCFbeta: Quantum chemistry calculations on GPU
(Message 61490)
Posted 7 May 2024 by Skip Da Shu Post: Average error % rate as of early 5/7/24 using last 3 data scrapes - AVG – last 3: 15.0 all cards 8GB – last 3: 22.58 (2x 3070) 10GB – last 3: 13.74 (2x 3080) 12GB – last 3: 2.30 (1x 4070S) Skip |
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Message boards :
News :
PYSCFbeta: Quantum chemistry calculations on GPU
(Message 61471)
Posted 21 Apr 2024 by Skip Da Shu Post: Steve replied:yes this make sense unfortunately. In the previous round of "inputs_v3**" it was calculating things incorrectly for any molecule containing Iodine. This is heaviest element in our dataset. The computational cost of this QM method scales with the size of the elements (it depends on the number of electrons). We are resending the incorrect calculations for Iodine containing molecules in this round of "v4" work units. Therefore the v4 set is a subset of the previous v3 WUs containing heavier elements, hence there are more OOM errors. Somethings coming around... error rates for 10GB cards are now under 13% and the 12GB card is ~3%. Skip |
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Message boards :
News :
PYSCFbeta: Quantum chemistry calculations on GPU
(Message 61470)
Posted 16 Apr 2024 by Skip Da Shu Post: Steve replied: yes this make sense unfortunately. In the previous round of "inputs_v3**" it was calculating things incorrectly for any molecule containing Iodine. This is heaviest element in our dataset. The computational cost of this QM method scales with the size of the elements (it depends on the number of electrons). We are resending the incorrect calculations for Iodine containing molecules in this round of "v4" work units. Therefore the v4 set is a subset of the previous v3 WUs containing heavier elements, hence there are more OOM errors. Any change in this situation? I got my 12GB card back and my haphazard data collection seems to have it under a 9% error rate and with the very last grab showing 5.85%. The 8GB & 10GB cards are still on NNW (other than 3 WUs i let thru on 10GB cards. They completed). Skip |
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Message boards :
News :
PYSCFbeta: Quantum chemistry calculations on GPU
(Message 61456)
Posted 10 Apr 2024 by Skip Da Shu Post: Thank you. U probably just saved me hours of wasted time. Error % AVG ALL: 29.1 AVG – last 3: 59.0 8GB – last 2 72.76 10GB – last 2 66.52 12GB – last 2 3.55 (card out for a week) |
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7)
Message boards :
News :
PYSCFbeta: Quantum chemistry calculations on GPU
(Message 61454)
Posted 10 Apr 2024 by Skip Da Shu Post: Error rates skyrocketed on me for this app... even on the 10GB cards (12GB card will be back on Thursday). This started late on April 7th. Error rate now over 50% so I will have to NNW till I can figure it out. Skip |
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8)
Message boards :
News :
PYSCFbeta: Quantum chemistry calculations on GPU
(Message 61404)
Posted 9 Mar 2024 by Skip Da Shu Post: Download error causing the zip file to be corrupted because it is missing the end of file signature. Well after 100+ of these errors I finally got 3 good ones out of that box after a reboot for a different reason. Thanx, Skip |
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Message boards :
News :
PYSCFbeta: Quantum chemistry calculations on GPU
(Message 61402)
Posted 9 Mar 2024 by Skip Da Shu Post: Anyone have insight into this error: <stderr_txt> 09:06:00 (130033): wrapper (7.7.26016): starting [x86_64-pc-linux-gnu__cuda1121.zip] End-of-central-directory signature not found. Either this file is not a zipfile, or it constitutes one disk of a multi-part archive. In the latter case the central directory and zipfile comment will be found on the last disk(s) of this archive. unzip: cannot find zipfile directory in one of x86_64-pc-linux-gnu__cuda1121.zip or x86_64-pc-linux-gnu__cuda1121.zip.zip, and cannot find x86_64-pc-linux-gnu__cuda1121.zip.ZIP, period. boinc_unzip() error: 9 It looks like every WU since the afternoon of the 7th (Zulu) is getting this but only on my single 12GB 4070S Skip |
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Message boards :
News :
PYSCFbeta: Quantum chemistry calculations on GPU
(Message 61401)
Posted 9 Mar 2024 by Skip Da Shu Post: to be expected with 8-10GB cards. They do: 8GB – last 2 checks of 2 cards 44.07 10GB – last 2 checks of 2 cards 30.80 12GB – last 2 checks of 1 card 7.62 But I need to look at the last day or two as rates have been going up. |
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Message boards :
News :
PYSCFbeta: Quantum chemistry calculations on GPU
(Message 61363)
Posted 4 Mar 2024 by Skip Da Shu Post: Going the wrong direction :-( Skip |
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Message boards :
News :
PYSCFbeta: Quantum chemistry calculations on GPU
(Message 61360)
Posted 3 Mar 2024 by Skip Da Shu Post: https://imgur.com/evCBB73 GPUGRID error rate across 2x 3070 8GB, 2x 3080 10GB & 1 4070 Super 12GB (early part is with 3x 3070 8GB one of which was replaced by 4070S 2/20). Skip |
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Message boards :
News :
PYSCFbeta: Quantum chemistry calculations on GPU
(Message 61295)
Posted 17 Feb 2024 by Skip Da Shu Post: between your systems and mine, looking at the error rates; IGNORE... all went to crap the next day (today) |
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Message boards :
News :
PYSCFbeta: Quantum chemistry calculations on GPU
(Message 61288)
Posted 16 Feb 2024 by Skip Da Shu Post: between your systems and mine, looking at the error rates; Not sure why but... Error rates seemed to start dropping after 5pm (23:00 Zulu) today. Overall error average since 2/11 across my 5 Nvid cards was 26.7% with it slowly creeping down over time. Early on a little bit of this was the result of lowering clocks to eliminate the occasional segfault (0x8b). The average of the last two captures today across the 5 cards was 20.5% For the last 6 hour period I just checked, my 10GB card average error rate dropped to 17.3% (15.92 & 18.7) and the 8GB card error rate was at 21.3%. Skip |
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Message boards :
News :
PYSCFbeta: Quantum chemistry calculations on GPU
(Message 61284)
Posted 14 Feb 2024 by Skip Da Shu Post:
Ah, it's an FP64 thing. Any other projects doing heavy FP64 lifting since the demise of MW GPU WUs? |
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Message boards :
News :
PYSCFbeta: Quantum chemistry calculations on GPU
(Message 61283)
Posted 14 Feb 2024 by Skip Da Shu Post:
Can you point me to someplace I can educate myself a bit on using Titan V cards for BOINC. I see some for $600 used on ebay. As u know there is no used market for used 'Super' cards yet. Did u mean 4x faster than a 4070 Super or than the 3070 I would replace with it? Thanx, Skip |
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Message boards :
News :
PYSCFbeta: Quantum chemistry calculations on GPU
(Message 61279)
Posted 14 Feb 2024 by Skip Da Shu Post: between your systems and mine, looking at the error rates; Thanx for info. As is right now the only cards I have w/ 16GB are my RX6800/6800xt cards. https://ibb.co/hKZtR0q Guess I need to start a go-fund-me for some $600 12GB 4070 Super cards that I've been eyeing up ;-) Skip |
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18)
Message boards :
News :
PYSCFbeta: Quantum chemistry calculations on GPU
(Message 61278)
Posted 14 Feb 2024 by Skip Da Shu Post: I'm seeing a bunch of checksum errors during unzip, anyone else have this problem? 8GB 3070 card errors today checked were all: CUDA Error of GINTint2e_jk_kernel: out of memory Skip |
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Message boards :
News :
PYSCFbeta: Quantum chemistry calculations on GPU
(Message 61277)
Posted 14 Feb 2024 by Skip Da Shu Post: I'm seeing a bunch of checksum errors during unzip, anyone else have this problem? 8GB 3070 card errors today checked were all: CUDA Error of GINTint2e_jk_kernel: out of memory Skip |
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20)
Message boards :
News :
PYSCFbeta: Quantum chemistry calculations on GPU
(Message 61275)
Posted 14 Feb 2024 by Skip Da Shu Post:
Thanx... as I suspected and this is my most common error now. Along with these that I'm thinking are also memory related also from a different point in the process... same situation w/o having reached the cap limit shown. https://www.gpugrid.net/result.php?resultid=33962293 Skip |
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