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Application
Materials Studio
1.0
Solvation Chemistry
0.0
Modules
Adsorption Locator
0.0048836073579684195
Amorphous Cell
0.006023115741494384
CASTEP
0.6106137066579846
COMPASS
0.01741819957675403
COMPASS III
0.0011395083835259645
COSMOconf
3.2557382386456127E-4
COSMOmic
0.0
COSMOquick
0.0
COSMOtherm
0.002279016767051929
Classical Simulations
0.04216181019046069
Conformers
0.0011395083835259645
Crystallization
0.008953280156275436
DFTB Plus
9.767214715936839E-4
DMol3
0.40696727983070163
Discover
0.0016278691193228065
Forcite
0.02230180693472245
GULP
0.005860328829562104
Mesocite
0.0
Mesoscale
0.0
Morphology
0.0021162298551196486
ONETEP
0.004558033534103858
Polymorph
0.0017906560312550871
QMERA
3.2557382386456127E-4
QSAR
0.0
Quantum Mechanics
1.0
Reflex
0.0048836073579684195
Reflex Plus
3.2557382386456127E-4
Semi-empirical
0.0019534429431873677
Sorption
0.002767377502848771
Synthia
0.0
TURBOMOLE
9.767214715936839E-4
VAMP
3.2557382386456127E-4
Visualization
0.0
X-Cell
1.6278691193228064E-4
Year
2003
0.0
2004
0.20828105395232122
2005
0.26223337515683814
2006
0.39523212045169387
2007
0.4190715181932246
2008
0.6273525721455459
2009
0.71267252195734
2010
0.5922208281053952
2011
0.2685069008782936
2012
0.08531994981179424
2013
0.012547051442910916
2014
0.15307402760351319
2015
0.3889585947302384
2016
0.20702634880803011
2017
0.013801756587202008
2018
0.35006273525721454
2019
0.15934755332496864
2020
0.5169385194479298
2021
0.4090338770388959
2022
1.0
2023
0.3462986198243413
2024
0.2245922208281054
2025
0.08657465495608532
2026
0.05897114178168131
Keywords
target
1.0
energy
0.2490669809467688
between
0.22431742290316245
experimental
0.16715772932626202
surface
0.11667648791985857
band
0.09526615596150069
chemical
0.08898055391868002
well
0.06560597132194068
stable
0.06049891966214889
adsorption
0.0553918680023571
applied
0.03574936161854252
formation
0.03535651149086624
potential
0.0347672362993518
crystal
0.03417796110783736
analysis
0.03280298566097034
stability
0.030642309958750738
optical
0.02455313297976822
metal
0.02121390689451974
temperature
0.012374779021803181
higher
0.011196228638774307
phase
0.010999803574936162
single
0.010214103319583579
doped
0.0058927519151443725
state
0.003928501276762915
interaction
0.0
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