8 Questions 1 Answers 0 Followers
Questions related from Choi Seung Gun
I've used Origin 2024 trial for 6 month. Now the licence is expired, I'm using Origin 2016 of which the licence is available for me. But, error message "The server application, source file, or...
03 June 2024 7,427 1 View
I'm trying relax calculation but scf accuracy is too big. So, I want to get Ba.pbe-n-kjpaw_psl.1.0.0.UPF but I cannot find it. Or it's OK if it is not paw of pbe. I don't care if it is...
18 August 2023 1,547 2 View
Hello, I'm beginner in DFT and I'm working on a MOF in the following article. https://www.nature.com/articles/s41467-022-34278-6#Sec10 I want to execute nscf, but, I don't know how I should...
09 March 2023 3,525 1 View
I want to calculate DOS of Si-doped graphite. But I get error Error in routine read_cards (5): wrong number of columns in ATOMIC_POSITIONS when my input file is like...
03 March 2023 9,126 2 View
My input file is too long so I'm attaching the file. I'm having problems 1. 2 of my atom UPF files are ignored. 2. Atomic positions below 5th line are all ignored. Can you help me with this? This...
03 March 2023 2,690 0 View
Exactly as said in the title. How can I measure the half-wave potential of the ORR catalyst on Ni foam?
28 August 2020 4,171 1 View
Hello, I'm a graduate student studying electrocatalyst. Is there any difference of ORR activity between as slurry and in-situ grown catalyst on Ni foam? And some paper says they scrape the...
28 August 2020 6,404 0 View
Hello! I'm using az 4620 as my PR. Usually, it is cured at 110 degree celsius under heating for 80 seconds. I know that, but I have to heat it at 300 degree celsius for 25 hours. I can't erase PR...
23 December 2019 9,475 1 View
