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Class AtomType

Atom type

Hierarchy

  • AtomType

Index

Constructors

Properties

Methods

Constructors

constructor

  • new AtomType(structure: Structure, atomname: string, element?: undefined | string): AtomType

Properties

atomname

atomname: string

the name of the atom

covalent

covalent: number

element

element: string

number

number: number

structure

structure: Structure

the structure object

vdw

vdw: number

Methods

getDefaultValence

  • getDefaultValence(): number

getOuterShellElectronCount

  • getOuterShellElectronCount(): number

getValenceList

  • getValenceList(): number[]

isActinide

  • isActinide(): boolean

isAlkaliMetal

  • isAlkaliMetal(): boolean

isAlkalineEarthMetal

  • isAlkalineEarthMetal(): boolean

isDiatomicNonmetal

  • isDiatomicNonmetal(): boolean

isHalogen

  • isHalogen(): boolean

isLanthanide

  • isLanthanide(): boolean

isMetal

  • isMetal(): boolean

isMetalloid

  • isMetalloid(): boolean

isNobleGas

  • isNobleGas(): boolean

isNonmetal

  • isNonmetal(): boolean

isPolyatomicNonmetal

  • isPolyatomicNonmetal(): boolean

isPostTransitionMetal

  • isPostTransitionMetal(): boolean

isTransitionMetal

  • isTransitionMetal(): boolean

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