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Application
Materials Studio
1.0
Solvation Chemistry
0.0
Modules
Adsorption Locator
0.05035759772705006
Amorphous Cell
0.3498579406289801
Blends
0.004702655040658372
CASTEP
0.025374742823552465
COMPASS
0.5151366709121191
COMPASS III
0.0560399725678456
COSMObase
0.0
COSMOperm
1.9594396002743216E-4
COSMOtherm
0.002351327520329186
Cantera
0.0
Classical Simulations
0.9999020280199863
Conformers
0.0032330753404526307
Crystallization
0.05045556970706378
DFTB Plus
0.005094542960713236
DMol3
0.06995199372979329
DPD
0.007151954541001274
Discover
0.013030273341824238
Forcite
1.0
GULP
0.002449299500342902
Kinetix
0.0
MesoDyn
0.0017634956402468895
Mesocite
0.006564122660918977
Mesoscale
0.012442441461741942
Morphology
0.021847751543058687
ONETEP
0.0
Polymorph
0.0018614676202606054
QMERA
9.797198001371608E-5
QSAR
0.0010776917801508768
Quantum Mechanics
0.09121191339276967
Reflex
0.027432154403840503
Reflex Plus
0.001175663760164593
Semi-empirical
0.009013422161261879
Sorption
0.051337317527187225
Synthia
0.001175663760164593
VAMP
0.003526991280493779
X-Cell
6.858038600960126E-4
Year
2003
0.0
2005
0.0019011406844106464
2006
0.004435994930291508
2007
0.014575411913814956
2008
0.026615969581749048
2009
0.022813688212927757
2010
0.023447401774397972
2011
0.027249683143219267
2012
0.08935361216730038
2013
0.11913814955640051
2014
0.12610899873257286
2015
0.13561470215462612
2016
0.11723700887198986
2017
0.13181242078580482
2018
0.15652724968314322
2019
0.2509505703422053
2020
0.49493029150823825
2021
0.45627376425855515
2022
0.8612167300380228
2023
1.0
2024
0.7782002534854245
2025
0.9695817490494296
2026
0.641318124207858
2027
0.004435994930291508
Keywords
target
1.0
cell
0.30123311802701114
amorphous
0.2920728126834997
between
0.2726952436876101
energy
0.19025249559600704
experimental
0.16805637110980623
adsorption
0.1465648854961832
surface
0.13728714034057546
performance
0.12178508514386377
temperature
0.07574867880211392
water
0.07375220199647681
interaction
0.059776864357017026
mechanism
0.05601879036993541
analysis
0.04979448032883147
chemical
0.04685848502642396
higher
0.04380504991192014
potential
0.023957721667645333
well
0.021256605989430417
increase
0.016793893129770993
polymer
0.016089254257193188
enhanced
0.013857897827363476
applied
0.004932472108044627
effective
0.0038755137991779215
formation
0.0037580739870816207
concentration
0.0
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