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hzb-catalysisLabs-schema

A datamodel for describing entities and their semantic associations (vocabularies/ontologies) for scientific (particularly catalytic) data at HZB, particularly for operando and in situ characterization of catalytic materials.

URI: https://w3id.org/https://github.com/HZB-CE-DataSchemas//hzb-catalysisLabs-schema

Name: hzb-catalysisLabs-schema

Classes

Class Description
CatalysisSampleCollection A holder for CatalysisSample objects
ChemicalOrDrugOrTreatment None
Entity An entity is anything that exists or has existed or will exist. Model class for all things and informational relationships, real or imagined.
        NamedEntity a databased entity or concept/class
                Beamline System within a facility designed to direct a beam of radiation toward a sample for the purpose of analysis or experimentation.
                        EMILOAESE OAESE beamline description.
                        EMILPink Pink beamline description.
                        MySpot Myspot beamline description.
                DataCite Represents metadata for datasets according to DataCite standard. Core properties of DataCite standard (basics for citation/publications.) DataCite already considers DublinCore elements.
                Device A thing made or adapted for a particular purpose, especially a piece of mechanical or electronic equipment.
                EnvironmentDynamics Dynamic or time-resolved environmental conditions during an experiment (e.g.for in-situ measurements).
                Experiment A systematic investigation designed to test hypotheses, gather data, or explore scientific principles through controlled conditions.
                        BeamlineExperiment An experimental investigation conducted using a beamline.
                File Stores data related to the experiment (e.g. images, videos, or other files).
                Measurement Storing and describing measurements to perform on a sample.
                Mixture A combination of two or more substances that are mixed together, which may retain their individual properties or interact chemically.
                Parameter Associates parameters on demand to a certain experiment or measurement.
                Person A basic/standard definition of a person, which later can be further defined as scientist, beam scientist, user, etc.
                        BeamlineScientist An expert responsible for the operation and scientific application of beamlines in a research facility.
                        Scientist An individual involved in research activities, and their details that are important to be referenced on experiments, projects, publivations, etc.
                Process A defined series of actions, steps, or operations undertaken to achieve a specific scientific or experimental outcome (e.g. atomic layer deposition).
                        AnalyticsProcess A defined series of actions, steps, or operations undertaken to achieve a analysis of a Catalysis sample process.
                        CatalyticActivityAssesmentProcess A defined series of actions, steps, or operations undertaken to achieve a analysis of a Catalysis sample process.
                        CharacterizationProcess A defined series of actions, steps, or operations undertaken to achieve a analysis of a Catalysis sample process.
                        CleaningProcess A defined series of actions, steps, or operations undertaken to achieve a cleaning process.
                                OzoneCleaning Surface treatment technique used in thin-film catalysis, especially for preparing or regenerating catalyst surfaces. It involves using ozone (O₃), a highly reactive form of oxygen, to clean and modify the surface properties of thin films.
                        SynthesisProcess A defined series of actions, steps, or operations undertaken to achieve a synthesis process. Update this definition.
                                ALD Atomic Layer Deposition (ALD) is a thin-film deposition technique that enables precise control over film thickness at the atomic level. This method is highly valued for its ability to deposit ultra-thin, conformal films with excellent uniformity, even on complex 3D surfaces.
                                        ALDBeneQ Atomic Layer Deposition (ALD) performed in BeneQ device.
                                CVD Chemical Vapor Deposition (CVD) is a process used to produce thin films and coatings by depositing material onto a substrate through chemical reactions of vapor-phase precursors.
                                        CVDNanofab Chemical Vapor Deposition (CVD) performed in the Nanofab chamber from the Oxford Cluster.
                                        CVDPc1 Chemical Vapor Deposition (CVD) performed in the pc1 chamber from the von Adenne cluster.
                                        CVDPc2 Chemical Vapor Deposition (CVD) performed in the pc2 chamber from the von Adenne cluster.
                                Sputtering Physical vapor deposition (PVD) technique used to deposit thin films onto a substrate. In sputtering, high-energy ions (usually from a plasma) bombard a target material, causing atoms from the target to be ejected. These ejected atoms then travel through a vacuum chamber and settle on a substrate, forming a thin film.
                                        SputteringPrevac Physical vapor deposition (PVD) technique used to deposit thin films onto a substrate, particularly with the Prevac sputtering machine. In sputtering, high-energy ions (usually from a plasma) bombard a target material, causing atoms from the target to be ejected. These ejected atoms then travel through a vacuum chamber and settle on a substrate, forming a thin film.
                                        SputteringVonAdenne Physical vapor deposition (PVD) technique used to deposit thin films onto a substrate, particularly with the von Adenne (PC3 chamber) machine.
                Project A research activity or initiative with defined objectives, funding, and timelines, involving one or more researchers, designed to generate data, publications, and other outputs. The project may involve multiple experiments, datasets, and contributors, and can be linked to specific funding sources and institutions.
                Reaction A chemical process in which one or more substances (reactants) undergo transformation to produce new substances (products).
                ReactionProduct A substance formed as a result of a chemical reaction, representing the end products generated from the transformation of reactants.
                Reactor Equipment designed to facilitate and control chemical reactions under specified conditions, such as temperature, pressure, and flow rates.
                Recipe A detailed set of instructions outlining the materials, quantities, and procedures required to perform a specific chemical reaction or experimental process.
                Sample Core properties of a sample, discipline agnostic.
                        CatalysisSample Core properties of a catalysis sample.
                                Catalyst A substance or material that increases the rate of a chemical reaction. Class including core properties of the synthesis characterization, and other experiments.
                                        PowderCatalyst Catalyst type. Core properties of a powder catalyst.
                                        ThinFilmCatalyst Catalyst type. Core properties of a thin film.
                SampleEnvironment Controlled environment in which the sample is studied (operando research).
                SamplePositioning The arrangement or location of samples within an experimental setup, critical for ensuring accurate data collection and analysis.
                Workflow A structured sequence of tasks, activities, or processes designed to accomplish a specific research objective or experimental goal.
ReactionProductCollection A holder for ReactionProduct objects
SampleCollection A holder for Sample objects

Slots

Slot Description
acronym The ORCID Identifier is a unique string that identifies a researcher
active_site The ORCID Identifier is a unique string that identifies a researcher
age_in_years Number of years since birth
AlternateIdentifier An identifier other than the primary Identifier applied to the resource being...
assigned_lab Working group (e
base_pressure Pressure inside the vacuum chamber before the introduction of the working gas...
batch_number Research institution or university the person is affiliated with (e
birth_date Date on which a person is born
catalyst The ORCID Identifier is a unique string that identifies a researcher
catalyst_activity The ORCID Identifier is a unique string that identifies a researcher
catalyst_components The ORCID Identifier is a unique string that identifies a researcher
catalyst_form The ORCID Identifier is a unique string that identifies a researcher
catalyst_handling_capability Working group (e
catalyst_name The ORCID Identifier is a unique string that identifies a researcher
catalyst_phase The ORCID Identifier is a unique string that identifies a researcher
catalyst_stability The ORCID Identifier is a unique string that identifies a researcher
catalyst_structure The ORCID Identifier is a unique string that identifies a researcher
catalyst_type The ORCID Identifier is a unique string that identifies a researcher
category
characterization_method The ORCID Identifier is a unique string that identifies a researcher
chemical__formula The ORCID Identifier is a unique string that identifies a researcher
chemical_composition The ORCID Identifier is a unique string that identifies a researcher
collaborators Project(s) that the researcher is involved in (e
commission_date Researcher's role in the department (e
composition Academic or professional title of the researcher (e
Contributor Creator of the resource
creator_institution The ORCID Identifier is a unique string that identifies a researcher
creator_name The ORCID Identifier is a unique string that identifies a researcher
creator_role The ORCID Identifier is a unique string that identifies a researcher
creators Creator(s) of the resource
crystalline_structure The ORCID Identifier is a unique string that identifies a researcher
current_address
Date Creator of the resource
date Date on which the process was performed
DC_RF DC (Direct Current) and RF (Radio Frequency) refer to the types of electrical...
department Department or division the researcher belongs to (e
description A human-readable description for a thing
Description Creator of the resource
device_id The Identifier is a unique string that identifies a resource (i
device_name The ORCID Identifier is a unique string that identifies a researcher
device_status Working group (e
device_type The ORCID Identifier is a unique string that identifies a researcher
eln_name The ORCID Identifier is a unique string that identifies a researcher
end_date Research institution or university the person is affiliated with (e
entries
experiment_id The Identifier is a unique string that identifies a resource (i
experiment_name The ORCID Identifier is a unique string that identifies a researcher
first_name The ORCID Identifier is a unique string that identifies a researcher
flow_rate Rate at which gases (typically inert gases like argon or reactive gases like ...
Format Technical format of the resource
FundingReference Creator of the resource
gas Gas used to ionize and bombard the target material (usually Argon)
gender
GeoLocation Creator of the resource
has_employment_history
holder Type of sample holder
id A unique identifier for a thing
identifier The Identifier is a unique string that identifies a resource (i
identifierType type of identifier
input_gases Working group (e
institution Research institution or university the person is affiliated with (e
institution_abbreviation The ORCID Identifier is a unique string that identifies a researcher
institution_name The ORCID Identifier is a unique string that identifies a researcher
institutions Researcher's role in the department (e
ip_address Working group (e
iri Internationalized Resource Identifier
laboratory_name Working group (e
Language Creator of the resource
last_name The ORCID Identifier is a unique string that identifies a researcher
loading The ORCID Identifier is a unique string that identifies a researcher
location Working group (e
mac_address Working group (e
manufacturer Academic or professional title of the researcher (e
model_number Research institution or university the person is affiliated with (e
morphology The ORCID Identifier is a unique string that identifies a researcher
name A human-readable name for a thing
notes Any notes for supporting the documentation of the process
operating_system Working group (e
orcid_id The ORCID Identifier is a unique string that identifies a researcher
orientation Refers to the spatial alignment and positioning of the target within the sput...
ownership Working group (e
particle_size The ORCID Identifier is a unique string that identifies a researcher
performed_by The ORCID Identifier is a unique string that identifies a researcher
person_id The Identifier is a unique string that identifies a resource (i
phase The ORCID Identifier is a unique string that identifies a researcher
pore_size_distribution The ORCID Identifier is a unique string that identifies a researcher
preparation_method Research institution or university the person is affiliated with (e
primary_email The main email address of a person
principal_investigator Area of expertise (e
process_user Person performing the process on the sample
project_code The ORCID Identifier is a unique string that identifies a researcher
project_id The Identifier is a unique string that identifies a resource (i
project_name The ORCID Identifier is a unique string that identifies a researcher
project_sample The ORCID Identifier is a unique string that identifies a researcher
projects Project(s) that the researcher is involved in (e
Publisher lorem
purchase_date Department or division the researcher belongs to (e
purity The ORCID Identifier is a unique string that identifies a researcher
ramp Controlled increase or decrease of temperature
reaction The ORCID Identifier is a unique string that identifies a researcher
related_project The ORCID Identifier is a unique string that identifies a researcher
RelatedIdentifier Identifiers of related resources
RelatedItem Creator of the resource
research_area Working group (e
research_focus Area of expertise (e
ResourceType lorem
responsible_person Working group (e
Rights Creator of the resource
role Researcher's role in the department (e
rotation Angular velocity at which the target material (or in some cases, the substrat...
sample The ORCID Identifier is a unique string that identifies a researcher
sample_id The Identifier is a unique string that identifies a resource (i
sample_description The ORCID Identifier is a unique string that identifies a researcher
sample_ELN_id The Identifier is a unique string that identifies a resource (i
sample_name The ORCID Identifier is a unique string that identifies a researcher
sample_owner Person owning the sample
serial_number The ORCID Identifier is a unique string that identifies a researcher
Size Size (e
size Research institution or university the person is affiliated with (e
specifications Working group (e
sputter_pressure Pressure of the gas (typically argon) inside the vacuum chamber during the sp...
sputtering_prevac_id Identifier of the sputtering process in the prevac machine
start_date Academic or professional title of the researcher (e
status Department or division the researcher belongs to (e
step_notes To add any notes regarding to the observations on that exact step on the whol...
step_number Many consecutive processes or steps of sputtering can be performed to layer t...
Subject lorem
substrate_id Identifier of the substrate material (usually Silicon)
substrate_temperature Temperature of the substrate onto which the thin film is being deposited duri...
support The ORCID Identifier is a unique string that identifies a researcher
surface_area The ORCID Identifier is a unique string that identifies a researcher
surface_chemistry The ORCID Identifier is a unique string that identifies a researcher
synthesis_method The ORCID Identifier is a unique string that identifies a researcher
target Target is the material that gets bombarded by ions and subsequently ejected (...
target_position Position of the target source
target_power The amount of electrical power applied to the sputtering target to generate t...
temperature Temperature inside the vacuum chamber before the introduction of the working ...
time Duration time of the sputtering step/process
title Title of the resource/dataset
Version Creator of the resource
vital_status living or dead status
warranty_expiration_date Area of expertise (e
z_position Vertical position of the substrate or the target material in the sputtering c...

Enumerations

Enumeration Description
GenderEnum
PersonStatus

Types

Type Description
Boolean A binary (true or false) value
ChemicalFormulaValue A chemical formula
Curie a compact URI
Date a date (year, month and day) in an idealized calendar
DateOrDatetime Either a date or a datetime
Datetime The combination of a date and time
Decimal A real number with arbitrary precision that conforms to the xsd:decimal speci...
Double A real number that conforms to the xsd:double specification
Float A real number that conforms to the xsd:float specification
Integer An integer
Jsonpath A string encoding a JSON Path
Jsonpointer A string encoding a JSON Pointer
Ncname Prefix part of CURIE
Nodeidentifier A URI, CURIE or BNODE that represents a node in a model
Objectidentifier A URI or CURIE that represents an object in the model
Sparqlpath A string encoding a SPARQL Property Path
String A character string
Time A time object represents a (local) time of day, independent of any particular...
Uri a complete URI
Uriorcurie a URI or a CURIE

Subsets

Subset Description