Table Of Contents

Previous topic

Requestables

Next topic

Returnables

Restrictables

The following keywords may be used as restrictables in TAP-VAMDC queries using VSS1 language, also they are added to registry for each new node.

Note that each node supports only a small subset of the keywords. The list of supported keywords may be retrieved through VOSI Capabilities service endpoint. See the TAP-VAMDC documentation for further details.

AsOfDate

Return data excluding any additions or improvements that were made after the given date (YYYY-MM-DD). This allows for reproducing an earlier query. Note that probably not all nodes support this.

Type: string

Constraints:

AtomInchi

Type: string

Constraints:

AtomInchiKey

Type: string

Constraints:

AtomIonCharge

Ionization stage with 0 for neutral

Type: integer number

Constraints: >=0

AtomMass

Atomic mass in Daltons, which is the same as the unified mass units (1Da = 1u = 1.660 538 86 (28) e-27)

Units: u

Type: floating-point number

Constraints: >1

AtomMassNumber

Units: u

Type: integer number

Constraints:

AtomNuclearCharge

Atomic number or nuclear charge

Type: integer number

Constraints: >0

AtomNuclearSpin

Type: floating-point number

Constraints:

AtomStateCoupling

Type: string

Constraints:

AtomStateEnergy

Energy of the level

Type: floating-point number

Constraints: >=0

AtomStateHyperfineMomentum

Type: floating-point number

Constraints:

AtomStateID

ID for an atomic state, e.g. for linking a process to the state

Type: string

Constraints:

AtomStateIonizationEnergy

Ionization energy in eV

Type: floating-point number

Constraints: >0

AtomStateKappa

Type: floating-point number

Constraints:

AtomStateLandeFactor

Lande factor

Type: floating-point number

Constraints:

AtomStateLifeTime

Life time of an atomic state in s.

Units: s

Type: floating-point number

Constraints: >0

AtomStateMagneticQuantumNumber

Type: floating-point number

Constraints:

AtomStateMixingCoefficient

Type: floating-point number

Constraints:

AtomStateParity

Type: string

Constraints:

AtomStatePolarizability

Type: floating-point number

Constraints:

AtomStateQuantumDefect

Type: floating-point number

Constraints:

AtomStateStatisticalWeight

Type: floating-point number

Constraints:

AtomSymbol

Atomic name

Type: string

Constraints:

CollisionIAEACode

Type: string

Constraints:

CollisionThreshold

Type: floating-point number

Constraints:

EnvironmentSpeciesConcentration

Type: floating-point number

Constraints:

EnvironmentSpeciesMoleFraction

Type: floating-point number

Constraints:

EnvironmentSpeciesPartialPressure

Type: floating-point number

Constraints:

EnvironmentTemperature

Environment temperature

Units: K

Type: floating-point number

Constraints: >0

EnvironmentTotalNumberDensity

Units: 1/cm3

Type: floating-point number

Constraints:

EnvironmentTotalPressure

Environment total pressure

Units: bar

Type: floating-point number

Constraints: >0

FunctionID

Type: string

Constraints:

FunctionName

Type: string

Constraints:

InchiKey

International Chemical Identifier (InChI) key (27-character or 14-character first part)

Type: string

Constraints:

MoleculeChemicalName

Conventional molecule name, e.g. CO2, NH3, Feh (may not be unique)

Type: string

Constraints:

MoleculeInchi

Type: string

Constraints:

MoleculeInchiKey

Type: string

Constraints:

MoleculeMolecularWeight

Type: floating-point number

Constraints:

MoleculeNormalModeHarmonicFrequency

Type: floating-point number

Constraints:

MoleculeNormalModeIntensity

Type: floating-point number

Constraints:

MoleculeStateCharacLifeTime

Molecular state lifetime in seconds

Units: s

Type: floating-point number

Constraints: >0

MoleculeStateCharacNuclearSpinSymmetry

Type: string

Constraints: (ortho|para|A|E|none)

MoleculeStateEnergy

Type: floating-point number

Constraints:

MoleculeStateID

Type: string

Constraints:

MoleculeStoichiometricFormula

Molecular stoichiometric formula

Type: string

Constraints:

NonRadTranEnergy

Type: floating-point number

Constraints:

NonRadTranProbability

Type: floating-point number

Constraints:

NonRadTranWidth

Type: floating-point number

Constraints:

NormalModeSymmetry

The character of the irreducible representation for this vibrational normal mode in the molecular point group

Type: string

Constraints:

RadTransBandCentre

Type: floating-point number

Constraints:

RadTransBandWidth

Type: floating-point number

Constraints:

RadTransEffectiveLandeFactor

Effective Lande factor for a given transition

Type: floating-point number

Constraints:

RadTransEnergy

Type: floating-point number

Constraints:

RadTransFrequency

Type: floating-point number

Constraints:

RadTransProbabilityA

Type: floating-point number

Constraints:

RadTransProbabilityIdealisedIntensity

Type: floating-point number

Constraints:

RadTransProbabilityLineStrength

Type: floating-point number

Constraints:

RadTransProbabilityLog10WeightedOscillatorStrength

Type: floating-point number

Constraints:

RadTransProbabilityOscillatorStrength

Type: floating-point number

Constraints:

RadTransProbabilityWeightedOscillatorStrength

Type: floating-point number

Constraints:

RadTransWavelength

Units: A

Type: floating-point number

Constraints:

RadTransWavenumber

Type: floating-point number

Constraints:

SourceCategory

Type of publication, e.g. journal, book etc.

Type: string

Constraints: Journal | Book | Proceedings | On-line

SourceYear

Publication Year

Type: integer number

Constraints: >0