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Hi Yicheng, It looks like insufficient memory to me. Please send us more information, like the mcdrtls, mcscfls, runls and runc. error files. What is the size of the basis set, the CAS and the number of configurations? Best regards, Hans On 3/28/2025</div>
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Hi Yicheng,<br>
It looks like insufficient memory to me. Please send us more
information, like the mcdrtls, mcscfls, runls and runc.error files.<br>
What is the size of the basis set, the CAS and the number of
configurations?<br>
Best regards, Hans<br>
<br>
On 3/28/2025 3:11 PM, Yicheng Zhu via Columbus wrote:
<blockquote type="cite"><!-- BaNnErBlUrFlE-BoDy-start -->
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Hi maintainers: I encountered the error when running MCSCF, what
could be the problem of it? The exceeding size of active space?
Best, Yicheng bummer (fatal): blkasn: left=-224336566
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Hi maintainers:
<div>I encountered the error when running MCSCF, what could be the
problem of it? The exceeding size of active space? </div>
<div>Best,</div>
<div>Yicheng</div>
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<p
style="margin: 0px; font-style: normal; font-variant-caps: normal; font-stretch: normal; font-size: 15px; line-height: normal; font-family: "Andale Mono"; font-size-adjust: none; font-kerning: auto; font-variant-alternates: normal; font-variant-ligatures: normal; font-variant-numeric: normal; font-variant-east-asian: normal; font-variant-position: normal; font-variant-emoji: normal; font-feature-settings: normal; font-optical-sizing: auto; font-variation-settings: normal; color: rgb(47, 255, 18); background-color: rgba(0, 0, 0, 0.9);">
<span style="font-variant-ligatures: no-common-ligatures">bummer
(fatal):blkasn: left=-224336566</span></p>
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<br>
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<pre wrap="" class="moz-quote-pre">_______________________________________________
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