KIFF Reactive Force Field Database is part of KIFF(KIST integrated force field platform).
This DB is results from the project "Development of Fundamental Technologies for Computational Nano Science Platform" funded by Ministry of Science, ICT and Future Planning of Korea.
The source of each force field is the papers published in journals to date, and force fields will continue to be added. Each article can be accessed through DOI column.
The description column is the text created with the first line of the original parameter set of the force field or the title of the research paper including the force field.
KIFF Database supports the rest api. You can get the list of informations of reactive force fields in KIFF through the following URL.
'element', 'author', and 'hash' can be used as search conditions.
For example, you can use the URL below to get information on the reactive force field that supports a list of elements containing carbon and nitrogen created by 'Han'.
The contents of information of each force field in 'data' array are:
|id||The id of force field in KIFF||Number|
|description||Force field description||Text|
|elements||List of elements supported by the the force field||JSON array|
|published||Date on which the paper containing the force field was published in the journal||Text
|author||The author(s) of research paper including the force field||Text|
|doi||The DOI(Digital Object Identifier) of research paper including the force field||Text|
|hash||The hash created by md5 algorithm for error checking of the parameters of the force field||Text|
You can get each reactive force field by id using the URL below.
The information obtained through the URL includes the following additional content:
|parameters||The parameters of the force field||Text|