Input parameters for ab initio molecular dynamics simulations of water at non-ambient pressure and temperature using the CP2K code

Additional information

Source Metadata

XML, HTML

Date added

26 August 2026

Harvest GUID

10c7531b-13e5-0b7d-e063-0937940a08a6

Dataset reference date (creation)

2024-02-02

Frequency of update

notApplicable

Access constraints

The copyright of materials derived from the British Geological Survey's work is vested in the Natural Environment Research Council [NERC]. No part of this work may be reproduced or transmitted in any form or by any means, or stored in a retrieval system of any nature, without the prior permission of the copyright holder, via the BGS Intellectual Property Rights Manager. Use by customers of information provided by the BGS, is at the customer's own risk. In view of the disparate sources of information at BGS's disposal, including such material donated to BGS, that BGS accepts in good faith as being accurate, the Natural Environment Research Council (NERC) gives no warranty, expressed or implied, as to the quality or accuracy of the information supplied, or to the information's suitability for any use. NERC/BGS accepts no liability whatever in respect of loss, damage, injury or other occurence however caused.

Responsible party

University of Bristol (originator); British Geological Survey (distributor, pointOfContact)

ISO 19139 resource type

nonGeographicDataset

Metadata language

eng