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Application
Materials Studio
1.0
Solvation Chemistry
0.0
Modules
Adsorption Locator
0.009784735812133072
Amorphous Cell
0.021526418786692758
CASTEP
0.684931506849315
COMPASS
0.03131115459882583
COMPASS III
0.015655577299412915
COSMOconf
0.0
COSMOperm
0.0
COSMOtherm
0.0
Classical Simulations
0.10763209393346379
Conformers
0.0
Crystallization
0.021526418786692758
DFTB Plus
0.0
DMol3
0.32093933463796476
Discover
0.0
Forcite
0.06262230919765166
GULP
0.0
Kinetix
0.0
Morphology
0.003913894324853229
ONETEP
0.003913894324853229
Polymorph
0.0019569471624266144
Quantum Mechanics
1.0
Reflex
0.0136986301369863
Semi-empirical
0.0
Sorption
0.015655577299412915
TURBOMOLE
0.0
Year
2026
1.0
2027
0.0
Keywords
target
1.0
energy
0.31536388140161725
performance
0.23450134770889489
between
0.19946091644204852
potential
0.1320754716981132
stability
0.1293800539083558
analysis
0.12668463611859837
strategy
0.09703504043126684
efficient
0.08355795148247978
formation
0.05660377358490566
band
0.05390835579514825
experimental
0.05390835579514825
promising
0.04851752021563342
stable
0.04043126684636118
reveal
0.03773584905660377
strong
0.029649595687331536
adsorption
0.026954177897574125
temperature
0.026954177897574125
enhanced
0.0215633423180593
optical
0.0215633423180593
surface
0.013477088948787063
framework
0.01078167115902965
design
0.008086253369272238
mechanical
0.0026954177897574125
effective
0.0
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