<html><head><style>p{margin-top:0px;margin-bottom:0px;}</style></head><body><div style="font-size:14px; font-family:Gulim,굴림,sans-serif;"><div style="font-variant-ligatures: normal; font-variant-caps: normal; letter-spacing: -0.5px; orphans: 2; text-align: start; text-indent: 0px; text-transform: none; widows: 2; word-spacing: 0px; -webkit-text-stroke-width: 0px; white-space: normal; background-color: rgb(255, 255, 255); text-decoration-thickness: initial; text-decoration-style: initial; text-decoration-color: initial;"><span style="font-size: 14px; font-style: normal; font-weight: 400; font-family: Gulim, 굴림, sans-serif; color: rgb(0, 0, 0);">Then, if I run starting_magnetization on one atom, the remaining atoms will have the same result whether starting_magnetization is set to 0 or 1?</span><br></div><div style="font-variant-ligatures: normal; font-variant-caps: normal; letter-spacing: -0.5px; orphans: 2; text-align: start; text-indent: 0px; text-transform: none; widows: 2; word-spacing: 0px; -webkit-text-stroke-width: 0px; white-space: normal; background-color: rgb(255, 255, 255); text-decoration-thickness: initial; text-decoration-style: initial; text-decoration-color: initial;"><br></div><div style="font-variant-ligatures: normal; font-variant-caps: normal; letter-spacing: -0.5px; orphans: 2; text-align: start; text-indent: 0px; text-transform: none; widows: 2; word-spacing: 0px; -webkit-text-stroke-width: 0px; white-space: normal; background-color: rgb(255, 255, 255); text-decoration-thickness: initial; text-decoration-style: initial; text-decoration-color: initial;"><span style="color: rgb(0, 0, 0);font-family: Gulim, 굴림, sans-serif;font-size: 14px;font-style: normal;font-variant-ligatures: normal;font-variant-caps: normal;font-weight: 400;letter-spacing: normal;orphans: 2;text-align: start;text-indent: 0px;text-transform: none;widows: 2;word-spacing: 0px;-webkit-text-stroke-width: 0px;white-space: normal;text-decoration-thickness: initial;text-decoration-style: initial;text-decoration-color: initial;float: none;display: inline !important;">Thank you</span><br style="color: rgb(0, 0, 0);font-family: Gulim, 굴림, sans-serif;font-size: 14px;font-style: normal;font-variant-ligatures: normal;font-variant-caps: normal;font-weight: 400;letter-spacing: normal;orphans: 2;text-align: start;text-indent: 0px;text-transform: none;widows: 2;word-spacing: 0px;-webkit-text-stroke-width: 0px;white-space: normal;text-decoration-thickness: initial;text-decoration-style: initial;text-decoration-color: initial;"><br style="color: rgb(0, 0, 0);font-family: Gulim, 굴림, sans-serif;font-size: 14px;font-style: normal;font-variant-ligatures: normal;font-variant-caps: normal;font-weight: 400;letter-spacing: normal;orphans: 2;text-align: start;text-indent: 0px;text-transform: none;widows: 2;word-spacing: 0px;-webkit-text-stroke-width: 0px;white-space: normal;text-decoration-thickness: initial;text-decoration-style: initial;text-decoration-color: initial;"><span style="color: rgb(0, 0, 0);font-family: Gulim, 굴림, sans-serif;font-size: 14px;font-style: normal;font-variant-ligatures: normal;font-variant-caps: normal;font-weight: 400;letter-spacing: normal;orphans: 2;text-align: start;text-indent: 0px;text-transform: none;widows: 2;word-spacing: 0px;-webkit-text-stroke-width: 0px;white-space: normal;text-decoration-thickness: initial;text-decoration-style: initial;text-decoration-color: initial;float: none;display: inline !important;">Sincerely,</span><br style="color: rgb(0, 0, 0);font-family: Gulim, 굴림, sans-serif;font-size: 14px;font-style: normal;font-variant-ligatures: normal;font-variant-caps: normal;font-weight: 400;letter-spacing: normal;orphans: 2;text-align: start;text-indent: 0px;text-transform: none;widows: 2;word-spacing: 0px;-webkit-text-stroke-width: 0px;white-space: normal;text-decoration-thickness: initial;text-decoration-style: initial;text-decoration-color: initial;"><span style="color: rgb(0, 0, 0);font-family: Gulim, 굴림, sans-serif;font-size: 14px;font-style: normal;font-variant-ligatures: normal;font-variant-caps: normal;font-weight: 400;letter-spacing: normal;orphans: 2;text-align: start;text-indent: 0px;text-transform: none;widows: 2;word-spacing: 0px;-webkit-text-stroke-width: 0px;white-space: normal;text-decoration-thickness: initial;text-decoration-style: initial;text-decoration-color: initial;float: none;display: inline !important;">Gimyung Park</span><br style="color: rgb(0, 0, 0);font-family: Gulim, 굴림, sans-serif;font-size: 14px;font-style: normal;font-variant-ligatures: normal;font-variant-caps: normal;font-weight: 400;letter-spacing: normal;orphans: 2;text-align: start;text-indent: 0px;text-transform: none;widows: 2;word-spacing: 0px;-webkit-text-stroke-width: 0px;white-space: normal;text-decoration-thickness: initial;text-decoration-style: initial;text-decoration-color: initial;"><span style="color: rgb(0, 0, 0);font-family: Gulim, 굴림, sans-serif;font-size: 14px;font-style: normal;font-variant-ligatures: normal;font-variant-caps: normal;font-weight: 400;letter-spacing: normal;orphans: 2;text-align: start;text-indent: 0px;text-transform: none;widows: 2;word-spacing: 0px;-webkit-text-stroke-width: 0px;white-space: normal;text-decoration-thickness: initial;text-decoration-style: initial;text-decoration-color: initial;float: none;display: inline !important;">Yonsei University</span></div><div><br></div><p style="font-size:10pt;font-family:sans-serif;padding:0 0 0 10pt"><span>-----Original Message-----</span><br><b>From:</b> "Paolo Giannozzi"<paolo.giannozzi@uniud.it> <br><b>To:</b> "Quantum ESPRESSO users Forum"<users@lists.quantum-espresso.org>; <br><b>Cc:</b> "박기명"<knppkm@naver.com>; <br><b>Sent:</b> 2024-12-29 (일) 00:28:34 (GMT+09:00)<br><b>Subject:</b> Re: [QE-users] [starting_magnetization]<br><br></p><br><br>On 28/12/2024 14:59, 박기명 wrote:<br><br>> If starting_magnetization is set to a non-zero value for at least one <br>> atom, are the other atoms automatically assigned appropriate <br>> magnetization values?<br><br>starting_magnetization is used mostly to break the symmetry; sometimes <br>it can be used to "nudge" the magnetization towards a given magnetic <br>structure (e.g. antiferromagnetic, by setting opposite initial <br>magnetizations to two sublattices). Atoms for which no <br>starting_magnetization is set may also acquire a non-zero magnetization <br>if the system likes that.<br><br>Paolo<br><br>> Although the starting_magnetization for the remaining atoms seems to be <br>> set to 0, the calculation results show that non-zero magnetization <br>> values also appear for those atoms.<br>> <br>> Thank you<br>> <br>> Sincerely,<br>> Gimyung Park<br>> Yonsei University<br>> <br>> <br>> _______________________________________________________________________________<br>> The Quantum ESPRESSO Foundation stands in solidarity with all civilians worldwide who are victims of terrorism, military aggression, and indiscriminate warfare.<br>> --------------------------------------------------------------------------------<br>> Quantum ESPRESSO is supported by MaX (<a href="http://www.max-centre.eu" target="_blank" rel="noopener noreferrer">www.max-centre.eu</a>)<br>> users mailing list users@lists.quantum-espresso.org<br>> <a href="https://lists.quantum-espresso.org/mailman/listinfo/users" target="_blank" rel="noopener noreferrer">https://lists.quantum-espresso.org/mailman/listinfo/users</a><br><br>-- <br>Paolo Giannozzi, Dip. Scienze Matematiche Informatiche e Fisiche,<br>Univ. Udine, via delle Scienze 206, 33100 Udine Italy, +39-0432-558216<br><br></div></body></html><table style='display:none'><tr><td><img src="https://mail.naver.com/readReceipt/notify/?img=3meR1XImW4R0pzk4aAmsKx%2BCKok0Mqv%2FMx0vFrMrK63oMqEdpA%2BSKA2rtzFXp6UmKAK5W4dQaXkqpBiqtzwGbX3q7NJ9M6ld%2B6dRpBFmb4kqbrY5WXiN.gif" border="0"/></td></tr></table>