Index

A

A adsorption Accelerating kinetic Monte Carlo Adsorbate-adsorbate interactions alpha (base.events.EventBase attribute) (NeighborKMC.base.events.EventBase attribute)

Assumptions atoms (base.system.SystemBase attribute) (NeighborKMC.base.system.SystemBase attribute)

B

base module base.events module

base.sites module base.system module

C

Calculating Turnover Frequencies Cite CO oxidation Code output Code overview

covered (base.sites.SiteBase attribute) (NeighborKMC.base.sites.SiteBase attribute) (NeighborKMC.examples.Pt_111_COOx.user_sites.Site attribute) (NeighborKMC.tutorials.A_ads.user_sites.Site attribute) (NeighborKMC.tutorials.B2_ads.user_sites.Site attribute)

D

diffev (base.events.EventBase attribute) (NeighborKMC.base.events.EventBase attribute)

do_event() (base.events.EventBase method) (NeighborKMC.base.events.EventBase method)

E

EventBase (class in base.events) (class in NeighborKMC.base.events)

F

find_nn_recurse() (base.system.SystemBase method) (NeighborKMC.base.system.SystemBase method)

G

get_coverages() (base.system.SystemBase method) (NeighborKMC.base.system.SystemBase method) get_involve_other() (base.events.EventBase method) (NeighborKMC.base.events.EventBase method)

get_ncovs() (base.system.SystemBase method) (NeighborKMC.base.system.SystemBase method) get_rate() (base.events.EventBase method) (NeighborKMC.base.events.EventBase method) Glossary

I

ind (base.sites.SiteBase attribute) (NeighborKMC.base.sites.SiteBase attribute) (NeighborKMC.examples.Pt_111_COOx.user_sites.Site attribute) (NeighborKMC.tutorials.A_ads.user_sites.Site attribute) (NeighborKMC.tutorials.B2_ads.user_sites.Site attribute)

Installation

K

kMC

L

lattice_pos (base.sites.SiteBase attribute) (NeighborKMC.base.sites.SiteBase attribute)

Literature

M

module base base.events base.sites base.system NeighborKMC.base NeighborKMC.base.events NeighborKMC.base.sites NeighborKMC.base.system NeighborKMC.examples.Pt_111_COOx.user_sites NeighborKMC.tutorials.A_ads.user_sites NeighborKMC.tutorials.B2_ads.user_sites

N

NeighborKMC.base module NeighborKMC.base.events module NeighborKMC.base.sites module NeighborKMC.base.system module

NeighborKMC.examples.Pt_111_COOx.user_sites module NeighborKMC.tutorials.A_ads.user_sites module NeighborKMC.tutorials.B2_ads.user_sites module

O

Options

P

Parallelisation params (base.events.EventBase attribute) (NeighborKMC.base.events.EventBase attribute)

possible() (base.events.EventBase method) (NeighborKMC.base.events.EventBase method)

Q

Quick start

R

Restarting MonteCoffee

S

Site (class in NeighborKMC.examples.Pt_111_COOx.user_sites) (class in NeighborKMC.tutorials.A_ads.user_sites) (class in NeighborKMC.tutorials.B2_ads.user_sites) SiteBase (class in base.sites) (class in NeighborKMC.base.sites) sites (base.system.SystemBase attribute) (NeighborKMC.base.system.SystemBase attribute) Special sites

Structure stype (base.sites.SiteBase attribute) (NeighborKMC.base.sites.SiteBase attribute) (NeighborKMC.examples.Pt_111_COOx.user_sites.Site attribute) (NeighborKMC.tutorials.A_ads.user_sites.Site attribute) (NeighborKMC.tutorials.B2_ads.user_sites.Site attribute) SystemBase (class in base.system) (class in NeighborKMC.base.system)

V

verify_nlist() (base.system.SystemBase method) (NeighborKMC.base.system.SystemBase method)