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Application

Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.03008987885892927 Amorphous Cell 0.06174286830793278 Blends 0.0015631105900742479 CASTEP 0.0719030871434154 COMPASS 0.0933958577569363 COMPASS III 0.032825322391559206 COSMOperm 0.0 COSMOtherm 0.0035169988276670576 Cantera 0.0 Classical Simulations 0.21688159437280188 Conformers 3.9077764751856197E-4 Crystallization 0.017194216490816726 DFTB Plus 0.006643220007815553 DMol3 1.0 DPD 0.0 Discover 0.0011723329425556857 Forcite 0.15787416959749903 GULP 0.004689331770222743 Kinetix 7.815552950371239E-4 Mesocite 7.815552950371239E-4 Mesoscale 7.815552950371239E-4 Morphology 0.003907776475185619 Polymorph 7.815552950371239E-4 QMERA 0.0011723329425556857 QSAR 7.815552950371239E-4 Quantum Mechanics 1.0 Reflex 0.01211410707307542 Semi-empirical 0.009378663540445486 Sorption 0.022665103556076593 Synthia 0.0011723329425556857 TURBOMOLE 3.9077764751856197E-4 VAMP 7.815552950371239E-4

Year

2020 0.0 2023 0.11291963377416073 2024 1.0 2025 0.9857578840284842 2026 0.49542217700915564

Keywords

target 1.0 energy 0.3027027027027027 adsorption 0.2294840294840295 between 0.2113022113022113 performance 0.1783783783783784 potential 0.13857493857493858 surface 0.12039312039312039 efficient 0.10958230958230958 analysis 0.07567567567567568 stability 0.06633906633906633 metal 0.06339066339066339 experimental 0.04864864864864865 promising 0.04815724815724816 stable 0.03931203931203931 effective 0.033906633906633905 mechanism 0.032432432432432434 enhanced 0.02800982800982801 chemical 0.02457002457002457 reaction 0.023095823095823097 design 0.022604422604422605 formation 0.020147420147420148 higher 0.015724815724815724 novel 0.011302211302211302 strategy 0.010319410319410319 efficiency 0.0
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