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Application
Materials Studio
1.0
Solvation Chemistry
0.0
Modules
Adsorption Locator
0.09322033898305085
Amorphous Cell
0.3728813559322034
CASTEP
0.635593220338983
COMPASS
0.423728813559322
COMPASS III
0.11440677966101695
COSMObase
0.0
COSMOtherm
0.07203389830508475
Classical Simulations
0.9364406779661016
Crystallization
0.05084745762711865
DMol3
0.3771186440677966
Discover
0.00847457627118644
Forcite
0.6567796610169492
GULP
0.01694915254237288
Mesocite
0.0
Mesoscale
0.0
Morphology
0.01694915254237288
ONETEP
0.0
Quantum Mechanics
1.0
Reflex
0.029661016949152543
Semi-empirical
0.0
Sorption
0.07203389830508475
VAMP
0.0
Visualization
0.18220338983050846
Year
2026
0.0
Keywords
target
1.0
energy
0.21534653465346534
performance
0.21534653465346534
between
0.19801980198019803
analysis
0.09158415841584158
experimental
0.09158415841584158
cell
0.07920792079207921
potential
0.07673267326732673
efficient
0.06930693069306931
adsorption
0.06435643564356436
stability
0.0594059405940594
amorphous
0.054455445544554455
promising
0.05198019801980198
enhanced
0.04950495049504951
mechanism
0.04950495049504951
surface
0.04950495049504951
temperature
0.04207920792079208
novel
0.039603960396039604
reveal
0.0297029702970297
efficiency
0.024752475247524754
design
0.017326732673267328
chemical
0.01485148514851485
higher
0.007425742574257425
stable
0.0024752475247524753
formation
0.0
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