Search

Categories

Organic Chemistry

(1)

Physical Chemistry

(1)

Theoretical and Computational Chemistry

(2)

Content Types

Working Paper

(2)

Published Date

Last 3 years

(2)

Last 12 months

(1)

Keywords

Authors

Thomas Gärtner

2 results in Authors: Thomas Gärtner

Theoretical and Computational Chemistry

The Anomalies and Local Structure of Liquid Water from Boiling to the Supercooled Regime as Predicted by the Many-Body MB-pol Model

Thomas E. Gartner III, Kelly M. Hunter, Eleftherios Lambros, Alessandro Caruso, Marc Riera, Gregory R. Medders, Athanassios Z. Panagiotopoulos, Pablo G. Debenedetti, Francesco Paesani

Version 2 posted 25 February 2022

1,091

Downloads

Theoretical and Computational Chemistry

Reaction Rebalancing: A Novel Approach to Curating Reaction Databases

Tieu-Long Phan, Klaus Weinbauer, Thomas Gärtner, Daniel Merkle, Jakob L. Andersen, Rolf Fagerberg, Peter F. Stadler

Version 1 posted 22 March 2024

334

Downloads

1

Citations