Dear all, I am doing SOC calculation in wien2k_17. I am getting some error in between SCF calculation (around 9th or 10th cycle) as below.
> lapw2 -up -p -c -so (13:21:14) running LAPW2 in parallel mode ** LAPW2 crashed! 0.100u 0.064s 0:03.96 4.0% 0+0k 422+352io 8pf+0w error: command /sw/xc40cle6/wien2k/17.1/cle6.05_intel18.0.1.163/wien2k-17.1/lapw2cpara -up -c -so uplapw2.def failed > stop error Could you please help me out with this? Best regards, Paresh Paresh Chandra Rout Postdoctoral Researcher King Abdullah University of Science and Technology (KAUST) Thuwal 23955-6900 Kingdom of Saudi Arabia Mobile: +966 565671754 Email address: paresh.r...@kaust.edu.sa 3231-WS13 -- This message and its contents, including attachments are intended solely for the original recipient. If you are not the intended recipient or have received this message in error, please notify me immediately and delete this message from your computer system. Any unauthorized use or distribution is prohibited. Please consider the environment before printing this email.
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