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Application

Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.014366729678638942 Amorphous Cell 0.024700693131695022 Blends 5.040957781978576E-4 CASTEP 0.6999369880277253 COMPASS 0.038185255198487714 COMPASS III 0.01285444234404537 COSMOconf 2.520478890989288E-4 COSMOperm 1.260239445494644E-4 COSMOquick 0.0 COSMOtherm 0.0020163831127914303 Cantera 0.0 Classical Simulations 0.09426591052299937 Conformers 1.260239445494644E-4 Crystallization 0.01285444234404537 DFTB Plus 0.002898550724637681 DMol3 0.3211090107120353 DPD 0.0 Discover 5.040957781978576E-4 Forcite 0.06452425960932577 GULP 0.0032766225582860744 Kinetix 2.520478890989288E-4 Mesocite 2.520478890989288E-4 Mesoscale 2.520478890989288E-4 Morphology 0.002898550724637681 ONETEP 0.002268431001890359 Polymorph 0.0010081915563957152 QMERA 3.780718336483932E-4 QSAR 2.520478890989288E-4 Quantum Mechanics 1.0 Reflex 0.008821676118462508 Reflex Plus 1.260239445494644E-4 Semi-empirical 0.003780718336483932 Sorption 0.009073724007561436 Synthia 3.780718336483932E-4 TURBOMOLE 8.821676118462507E-4 VAMP 2.520478890989288E-4 X-Cell 2.520478890989288E-4

Year

2020 3.222687721559781E-4 2023 0.0970029004189494 2024 0.970673541733806 2025 1.0 2026 0.48759265227199483 2027 0.0

Keywords

target 1.0 energy 0.2998902649318075 between 0.18388462141401474 potential 0.1566076187490202 performance 0.13340649004546168 stability 0.11788681611537859 analysis 0.1116162407900925 optical 0.08872864085279825 band 0.0790092490986048 experimental 0.0760307258190939 adsorption 0.05737576422636777 promising 0.05282959711553535 stable 0.05063489575168522 surface 0.049851073836024454 efficient 0.03605580812039504 enhanced 0.023984950619219313 formation 0.021633484872237027 novel 0.017087317761404607 chemical 0.015049380780686628 mechanical 0.013324972566232952 reveal 0.01050321366985421 higher 0.010346449286722056 metal 0.00924909860479699 temperature 0.007054397240946857 design 0.0
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