ℹ️
🇬🇧
Search
Search for publications relevant for "integral molecular-dynamics"
integral molecular-dynamics
Publication
Class
Person
Publication
Programmes
publication
Resonance-assisted stabilisation of hydrogen bonds probed by NMR spectroscopy and path integral molecular dynamics
2015 |
Central Library of Charles University
publication
i-PI 2.0: A universal force engine for advanced molecular simulations
2019 |
Faculty of Mathematics and Physics
publication
Persistent Homology Metrics Reveal Quantum Fluctuations and Reactive Atoms in Path Integral Dynamics
2021 |
Faculty of Mathematics and Physics
publication
Influence of Intramolecular Charge Transfer and Nuclear Quantum Effects on Intramolecular Hydrogen Bonds in Azopyrimidines
2017 |
Central Library of Charles University, Faculty of Science
publication
Significance Of Nuclear Quantum Effects In Hydrogen Bonded Molecular Chains
2021 |
Faculty of Mathematics and Physics
publication
The hydrogen bond continuum in solid isonicotinic acid
2022 |
Central Library of Charles University, Faculty of Science
publication
The Quest for Accurate Liquid Water Properties from First Principles
2018 |
Faculty of Mathematics and Physics
publication
Anomalous freezing of low-dimensional water confined in graphene nanowrinkles
2020 |
Faculty of Mathematics and Physics