A PHP Error was encountered

Severity: Warning

Message: file_get_contents(https://...@pubfacts.com&api_key=b8daa3ad693db53b1410957c26c9a51b4908&a=1): Failed to open stream: HTTP request failed! HTTP/1.1 429 Too Many Requests

Filename: helpers/my_audit_helper.php

Line Number: 176

Backtrace:

File: /var/www/html/application/helpers/my_audit_helper.php
Line: 176
Function: file_get_contents

File: /var/www/html/application/helpers/my_audit_helper.php
Line: 250
Function: simplexml_load_file_from_url

File: /var/www/html/application/helpers/my_audit_helper.php
Line: 3122
Function: getPubMedXML

File: /var/www/html/application/controllers/Detail.php
Line: 575
Function: pubMedSearch_Global

File: /var/www/html/application/controllers/Detail.php
Line: 489
Function: pubMedGetRelatedKeyword

File: /var/www/html/index.php
Line: 316
Function: require_once

Meijer-G and other resummation strategies for the Møller-Plesset perturbation series. | LitMetric

Meijer-G and other resummation strategies for the Møller-Plesset perturbation series.

J Chem Phys

Department of Chemistry and Chemical Biology, McMaster University, 1280 Main Street West, Hamilton, Ontario L8S 4M1, Canada.

Published: November 2024

We compare various resummation techniques on truncated Møller-Plesset perturbation series. Our main results are for Padé, Borel-Padé, and Meijer G resummation techniques. All these resummation techniques improve the energies from truncated Møller-Plesset perturbation theory when the perturbation series is not-too-ill-behaved, but the Meijer-G resummation is arguably the best resummation, at least for low orders. An especially useful feature of the Meijer-G resummation is when it is unreliable, the predicted energy often has a nonnegligible imaginary part, making it possible to preemptively screen out some unreliable results.

Download full-text PDF

Source
http://dx.doi.org/10.1063/5.0238490DOI Listing

Publication Analysis

Top Keywords

meijer-g resummation
12
møller-plesset perturbation
12
perturbation series
12
resummation techniques
12
truncated møller-plesset
8
resummation
6
resummation strategies
4
strategies møller-plesset
4
perturbation
4
series compare
4

Similar Publications

Want AI Summaries of new PubMed Abstracts delivered to your In-box?

Enter search terms and have AI summaries delivered each week - change queries or unsubscribe any time!