Analytic gradients for state-averaged multiconfiguration pair-density functional theory

Title
Analytic gradients for state-averaged multiconfiguration pair-density functional theory
Authors
Keywords
-
Journal
JOURNAL OF CHEMICAL PHYSICS
Volume 153, Issue 1, Pages 014106
Publisher
AIP Publishing
Online
2020-07-07
DOI
10.1063/5.0007040

Ask authors/readers for more resources

Discover Peeref hubs

Discuss science. Find collaborators. Network.

Join a conversation

Add your recorded webinar

Do you already have a recorded webinar? Grow your audience and get more views by easily listing your recording on Peeref.

Upload Now