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Application

Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.00781388740898597 Amorphous Cell 0.00728112235837329 CASTEP 1.0 COMPASS 0.012786361214704315 COMPASS III 0.003906943704492985 COSMOperm 0.0 COSMOquick 0.0 Classical Simulations 0.04226602734860593 Crystallization 0.011365654413070502 DFTB Plus 0.0015982951518380393 DMol3 0.03178831468655656 Discover 0.0 Forcite 0.02503995737879595 GULP 0.003551767004084532 Kinetix 0.0 Morphology 0.0019534718522464926 ONETEP 0.0019534718522464926 Polymorph 7.103534008169064E-4 QMERA 0.0 Quantum Mechanics 1.0 Reflex 0.00834665245959865 Reflex Plus 1.775883502042266E-4 Semi-empirical 0.001775883502042266 Sorption 0.0028414136032676256 X-Cell 3.551767004084532E-4

Year

2023 0.174408014571949 2024 0.9093806921675774 2025 1.0 2026 0.47859744990892533 2027 0.0

Keywords

target 1.0 energy 0.29825722479594086 optical 0.17824840061769248 between 0.16677696889477167 potential 0.15530553717185086 stability 0.13346569600705935 band 0.1328038826384293 analysis 0.12309728656518862 performance 0.10765497463048754 experimental 0.08405029781601589 mechanical 0.07015221707478492 stable 0.05118023384072358 promising 0.04897418927862343 crystal 0.022501654533421574 surface 0.018751378777851314 formation 0.013898080741230973 reveal 0.01257445400397088 enhanced 0.012353849547760865 novel 0.010368409441870726 temperature 0.00816236487977057 phase 0.007500551511140525 higher 0.003970880211780278 optoelectronic 0.0013236267372600927 chemical 0.0 strong 0.0
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