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Application

Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.03268206039076377 Amorphous Cell 0.056483126110124335 Blends 0.0010657193605683837 CASTEP 0.07495559502664298 COMPASS 0.09094138543516873 COMPASS III 0.029129662522202487 COSMOperm 0.0 COSMOtherm 0.003907637655417406 Cantera 0.0 Classical Simulations 0.21207815275310835 Conformers 7.104795737122557E-4 Crystallization 0.015985790408525755 DFTB Plus 0.005683836589698046 DMol3 1.0 DPD 0.0 Discover 0.0010657193605683837 Forcite 0.15097690941385436 GULP 0.0053285968028419185 Kinetix 7.104795737122557E-4 Mesocite 3.5523978685612787E-4 Mesoscale 3.5523978685612787E-4 Morphology 0.003907637655417406 Polymorph 7.104795737122557E-4 QMERA 0.002486678507992895 QSAR 3.5523978685612787E-4 Quantum Mechanics 1.0 Reflex 0.011012433392539964 Semi-empirical 0.009591474245115453 Sorption 0.023801065719360567 Synthia 0.0010657193605683837 TURBOMOLE 3.5523978685612787E-4 VAMP 7.104795737122557E-4

Year

2020 0.0 2022 0.07253886010362694 2023 0.48497409326424873 2024 0.8487046632124352 2025 1.0 2026 0.505699481865285

Keywords

target 1.0 energy 0.28900709219858156 adsorption 0.23049645390070922 between 0.20833333333333334 performance 0.16888297872340424 surface 0.14051418439716312 potential 0.1276595744680851 efficient 0.09973404255319149 analysis 0.06693262411347518 metal 0.06471631205673758 stability 0.05939716312056738 experimental 0.051418439716312055 promising 0.043882978723404256 mechanism 0.041223404255319146 reaction 0.027925531914893616 stable 0.0274822695035461 effective 0.02526595744680851 chemical 0.02304964539007092 formation 0.0199468085106383 enhanced 0.016843971631205674 design 0.012854609929078014 higher 0.00576241134751773 strategy 0.0035460992907801418 novel 0.002216312056737589 catalyst 0.0
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