Evidence map›Paper›PMID 39718452›Full record

ArticleJournal of computational chemistry2025

Does Basis Set Superposition Error Significantly Affect Post-CCSD(T) Corrections?

Vladimir Fishman, Emmanouil Semidalas, Margarita Shepelenko, Jan M L Martin

Abstract read
In one paragraph

Article in Journal of computational chemistry, 2025. The graph could read no effect estimate from its abstract, so it casts no vote on the map. Cited by 3 papers.

0numbers the graph read from it
0cells of the map it votes in
3citing papers in PubMed
–field-weighted citation impact
1 · What the graph read from it

What it found

Each row is one number read from the abstract, on the scale the paper reported it, with its interval. Left of the dashed line favours the treatment, right favours the comparator. Under each row is the sentence it came from. New to these charts? A ten-minute tutorial.

The abstract states no effect estimate the extractor could read, or names no intervention and outcome on the map, so this paper lights no cell and moves no belief. It is still indexed, cited and linked below.

2 · The registry

The trial behind it

Trials whose registry record cites this paper, or whose number appears in the abstract. A trial that started after this paper was published is citing it as background, not reporting it.

Neither the registry nor the abstract names a trial number. If this is a trial report, that itself is worth knowing.

3 · Its place in the literature

Who cites it

3 citing papers in PubMed.

  1. Article
  2. Article
  3. Article
4 · The record

Corrections and comments

PubMed lists nothing against this paper. Absence here is not a guarantee, only a check that was made.

5 · Who and what money

Authors and funding

4 authors.

Vladimir FishmanDepartment of Molecular Chemistry and Materials Science, Weizmann Institute of Science, Rehovot, Israel.ORCID https://orcid.org/0009-0004-7570-136X
Emmanouil SemidalasDepartment of Molecular Chemistry and Materials Science, Weizmann Institute of Science, Rehovot, Israel.ORCID https://orcid.org/0000-0002-4464-4057
Margarita ShepelenkoDepartment of Molecular Chemistry and Materials Science, Weizmann Institute of Science, Rehovot, Israel.ORCID https://orcid.org/0000-0003-4707-1650
Jan M L MartinDepartment of Molecular Chemistry and Materials Science, Weizmann Institute of Science, Rehovot, Israel.ORCID https://orcid.org/0000-0002-0005-5074

Funding

Israel Science Foundation 1969/20
6 · The paper itself

Abstract

We have investigated the title question for both a subset of the W4-11 total atomization energies benchmark, and for the A24x8 noncovalent interactions benchmark. Overall, counterpoise corrections to post-CCSD(T) contributions are about two orders of magnitude less important than those to the CCSD(T) interaction energy. Counterpoise corrections for connected quadruple substitutions (Q) are negligible, and

Indexed as

basis set superposition error (BSSE)noncovalent interactionspost‐CCSD(T) correlation effectsthermochemistry

Identifiers

PMID39718452
PMCPMC11668233

What OpenQuestion holds

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Registered trials

None linked

Read under generation 80e0d062 · epoch 390. Bibliography from PubMed, PubMed Central and OpenAlex; grants from NIH RePORTER; trial links from ClinicalTrials.gov; estimates, votes and beliefs from the OpenQuestion graph.