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Application

Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.007813630444219361 Amorphous Cell 0.006945449283750542 CASTEP 1.0 COMPASS 0.013022717407032267 COMPASS III 0.0036174215019534077 COSMOperm 0.0 COSMOquick 0.0 Classical Simulations 0.04355375488351903 Crystallization 0.012878020546954132 DFTB Plus 0.0015916654608594994 DMol3 0.03487194327883085 Discover 1.446968600781363E-4 Forcite 0.02503255679351758 GULP 0.004485602662422226 Kinetix 0.0 Morphology 0.0028939372015627262 ONETEP 0.0014469686007813631 Polymorph 5.787874403125452E-4 QMERA 2.893937201562726E-4 Quantum Mechanics 1.0 Reflex 0.009549992765156995 Reflex Plus 2.893937201562726E-4 Semi-empirical 0.0020257560410939083 Sorption 0.0028939372015627262 X-Cell 2.893937201562726E-4

Year

2019 0.0 2021 0.0 2022 0.36065573770491804 2023 0.4057377049180328 2024 0.8989071038251366 2025 1.0 2026 0.47859744990892533 2027 0.0

Keywords

target 1.0 energy 0.2926657263751763 optical 0.1733074753173484 between 0.1717207334273625 band 0.14227785613540198 potential 0.14016220028208745 stability 0.12182651622002821 analysis 0.11530324400564175 performance 0.1024330042313117 experimental 0.10155148095909731 mechanical 0.06805359661495064 stable 0.06241184767277856 promising 0.04672073342736248 surface 0.04196050775740479 crystal 0.03684767277856135 temperature 0.02009873060648801 formation 0.016748942172073344 phase 0.016396332863187587 higher 0.014280677009873061 chemical 0.012870239774330043 reveal 0.012517630465444287 novel 0.010754583921015515 enhanced 0.008815232722143865 strong 0.004936530324400564 well 0.0
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