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Application

Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.008392417884531905 Amorphous Cell 0.0065113587035161334 CASTEP 1.0 COMPASS 0.012878020546954132 COMPASS III 0.0036174215019534077 COSMOperm 0.0 COSMOquick 0.0 Classical Simulations 0.042540876862972074 Crystallization 0.010996961365938359 DFTB Plus 0.0015916654608594994 DMol3 0.03443785269859644 Discover 0.0 Forcite 0.02387498191289249 GULP 0.0043409058023440895 Kinetix 0.0 Morphology 0.001881059181015772 ONETEP 0.0017363623209376356 Polymorph 5.787874403125452E-4 QMERA 0.0 Quantum Mechanics 1.0 Reflex 0.008392417884531905 Reflex Plus 2.893937201562726E-4 Semi-empirical 0.0017363623209376356 Sorption 0.0026045434814064533 X-Cell 2.893937201562726E-4

Year

2019 4.5599635202918376E-4 2021 0.19334245326037391 2022 0.39443684450524397 2023 0.4017327861377109 2024 0.6789785681714546 2025 1.0 2026 0.4792521659826721 2027 0.0

Keywords

target 1.0 energy 0.2894179894179894 between 0.17231040564373898 optical 0.16560846560846562 band 0.13562610229276895 potential 0.13051146384479717 stability 0.11887125220458554 analysis 0.10317460317460317 performance 0.09365079365079365 experimental 0.09241622574955909 mechanical 0.06049382716049383 stable 0.05873015873015873 surface 0.0417989417989418 promising 0.04144620811287478 crystal 0.03597883597883598 formation 0.018871252204585538 phase 0.01798941798941799 temperature 0.016225749559082892 reveal 0.01164021164021164 novel 0.008818342151675485 higher 0.008465608465608466 enhanced 0.007054673721340388 chemical 0.006172839506172839 well 0.0012345679012345679 strong 0.0
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