In GaussView /Gaussian calculation, Ii get open-new-file error. Why I am getting nad how to resolve?

Savarimuthu vincent de paul @Savarimuthu-Vincent-De-Paul

12 February 2024 0 6K Report

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PACYC PCR not working after several attempts. Would anyone have any suggestions?

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Quantifying leaking DNA from bacteria - what's the secret?

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Please let me know how to remove mycoplasma contamination from cell line?

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FDC and FRC cell populations in mouse spleen?

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How to raise temperature in small increments during equilibration in LAMMPS?

All, I am trying to equilibrate an Ice 1h crystalline structure to 250K in LAMMPS. When I tried to do this at 250K directly, the structure lost it's crystalline shape and became disordered post...

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Western blot protein of interest falling at a lower weight than expected?

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For acid treated montmorillonite clays what will be the result of surface area?

The organo montmorillonite nanoclays modified with octadecylamine were used for the experiment. After acid treatment, the surface area will be increase. However, in my experiment, the surface area...

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Which Journals would you advise to submit a Letter which briefly talks about neurosurgical treatment of neuro-oncological patient during Sars-COV-2?

Possibily not an open access journal which does not add any publishing costs once being accepted. Thank you in advance

09 February 2021 717 6 View

How to resolve Gaussian error termination " Error termination via Lnk1e in F:\G16W\l103.exe" for TS(QST3)?

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How to calculate the Atomic Polar Tensor using DFT ?

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Access to supercomputer resources in India?

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Why we use feature normalization before using the Gaussian kernel in SVM?

Support vector machine

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Does Gaussian 09W software take too long to give a result if we have a large chemical structure ?

DFT - gaussviev - gaussian09W - HOMO - LUMO

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How to calculate enthalpy of formation of Polymers taking into account the terminal end groups?

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How to identify when a gaussian program is about terminate normally?

Dear all, I am trying to optimize a bimetallic complex using # opt=tight b3lyp/lanl2dz scf=qc geom=connectivity. The program is running for around 5 days but the size of the .chk remains same...

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Does the power law behavior can be approximated with Gaussians?

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How to calculate radial distribution function (RDF) of a complex from Ab initio MD simulation trajectory?

Hi all, Is there any software or webserver to read the molecular dynamics (MD) simulation trajectory which obtained from Ab initio MD simulation to calculate the atom-atom radial distribution...

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