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code version 7.5  (TURBOMOLE GmbH)

 
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    TURBOMOLE GmbH code version 7.5
    Code Version 7.5, supplied by TURBOMOLE GmbH, used in various techniques. Bioz Stars score: 90/100, based on 1 PubMed citations. ZERO BIAS - scores, article reviews, protocol conditions and more
    https://www.bioz.com/product/code+version+7%2E5/code+version+7+5/pmc12172018-52-8-8
    Average 90 stars, based on 1 article reviews
    code version 7.5 - by Bioz Stars, 2026-09
    90/100 stars

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    other:

    Article Title: The effect of particle size and composition on the optical and electronic properties of CdO and CdS rocksalt nanoparticles.
    Article Snippet: 58 All calculations were performed using version 7.5 of the Turbomole code and used a tight integration grid (m5) and tight SCF convergence criteria (scftol and denconv 1 10 7).

    Article Title: The effect of alkyl termination on the optical and electronic properties of silicon nanoparticles
    Article Snippet: Throughout all these calculations, version 7.5 of the Turbomole code was employed in combination with a tight integration grid (m5), stringent SCF convergence criteria (denconv. set at 1 × 10 −7 ), and the resolution of identity (RI-J) approximation, which accelerated the computation of the Coulomb integrals.

    Article Title: The effect of particle size on the optical and electronic properties of hydrogenated silicon nanoparticles.
    Article Snippet: These TDDFT calculations used the Tamm–Dancoff approximation to avoid TDDFT stability issues.54 Throughout all these calculations, version 7.5 of the Turbomole code was employed in combination with a tight integration grid (m5), stringent SCF convergence criteria (denconv set at 1 10 7) and the RI-J approximation.55–57 Additionally, the RI-K approximation was applied in all GW and BSE calculations, and in the G0W0 and evGW calculations we exploited the RIGW algorithms implemented in Turbomole,52 where only the highest occupied and lowest unoccupied quasiparticle states are explicitly calculated and the remainder of the Kohn–Sham spectrum is shifted accordingly.



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