Student or educator? Sign up with your school email and get 6 months of Pro free.
CoChat
Sign Up
Cited by 261

The DOI matches its Crossref record; 28 of the 28 references it cites were found in a registry or an index.

Structure of Water Clusters. The Contribution of Many-Body Forces, Monomer Relaxation, and Vibrational Zero-Point Energy

Gregory, Jonathon K., Clary, David C.·1996·The Journal of Physical Chemistry
DOI 10.1021/jp9616019
Open this paper in CoChat — free account

Abstract

The vibrationally averaged properties of small water clusters from the dimer to the hexamer are discussed. The potential energy surface used contains explicit many-body terms which allows the non-pairwise interactions to be considered. The ground vibrational states are calculated accurately using a diffusion quantum Monte Carlo algorithm which gives vibrationally averaged rotational constants in good agreement with experiment. The many-body forces cause a destabilization of the more closed structures, and there is a significant variation in the intermolecular zero-point energies for different structures. Cyclic structures are easily the most stable for the trimer and tetramer; in the latter case, this is probably due to the three- and four-body forces. The cyclic pentamer is also probably the structure with the highest dissociation energy when all effects are considered. For the hexamer, a noncyclic cagelike structure is found to be most stable and its stability is due to a relatively low zero-point energy.

Overview

The claims and statistics of this paper haven’t been checked yet.

Run the check — free, no account needed. It reads the open-access text and checks the sources it cites.

A few free checks a day · papers already verified open instantly · results are public

Integrity signals

Registry

Crossref · 10.1021/jp9616019

Cites

28 of 28 references verified0 citation errors · 0 not checkable

Statistics

Verification

Claims the paper makes

The claims and statistics of this paper haven’t been checked yet.

Run the check — free, no account needed. It reads the open-access text and checks the sources it cites.

A few free checks a day · papers already verified open instantly · results are public

Self-check

Percentages, sums and reported differences re-computed from the paper’s own numbers.

The self-check needs the paper’s full text.

Citations

Cites

Cited by

See all 261

Metadata

Authors
Gregory, J. K., & Clary, D. C.
Venue
The Journal of Physical Chemistry
Publisher
American Chemical Society (ACS)
Published
1996-01-01
Volume
100
Issue
46
Pages
18014-18022
ISSN
  • 0022-3654 (ISSN-L)
  • 1541-5740
DOI
10.1021/jp9616019
OpenAlex
W2020124883
Cited by
261
References
28
FWCI
12.48
Type
journal article
Language
en
Open access
closed

About these checks

Registry, retraction, Cites and statistics results are computed, not judged, with one exception: a printed reference that no index lists is read once by a model before it counts as a citation error. Claims are extracted by a model and kept only when their quote appears verbatim in the text; each cited source is then checked, with a model’s help, for whether it says what the claim relies on. Those verdicts can be wrong — read the claim’s quote and the cited source before relying on one.

Statistics and arithmetic are recomputed, not judged.

Confidence bands are shown only for fields calibrated on our annotated test set. None is calibrated yet, so no band is shown.

What counts as a claim ›How we measure confidence ›How we check this ›

Are you an author, or do you see a problem with this page? Request a review

Data sources

Bibliographic data: Semantic Scholar, OpenAlex, Crossref.

Contains information from the Semantic Scholar Academic Graph Datasets, made available under the ODC Attribution License (ODC-BY 1.0).

Semantic Scholar’s data is described in: Kinney, R., et al. (2023). The Semantic Scholar Open Data Platform. arXiv:2301.10140.