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Application

Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.01074743527112848 Amorphous Cell 0.008304836345872008 CASTEP 1.0 COMPASS 0.013678553981436248 COMPASS III 0.006350757205666829 COSMOperm 0.0 COSMOquick 0.0 Classical Simulations 0.05276013678553981 Crystallization 0.010258915486077186 DFTB Plus 9.770395701025891E-4 DMol3 0.03175378602833415 Forcite 0.032730825598436736 GULP 0.004885197850512946 Kinetix 0.0 Morphology 0.0019540791402051783 ONETEP 4.885197850512946E-4 Polymorph 9.770395701025891E-4 QMERA 0.0 Quantum Mechanics 1.0 Reflex 0.006839276990718124 Reflex Plus 0.0 Semi-empirical 0.0014655593551538837 Sorption 0.002442598925256473

Year

2025 0.9550669216061185 2026 1.0 2027 0.0

Keywords

target 1.0 energy 0.31362467866323906 potential 0.18958868894601544 optical 0.18251928020565553 analysis 0.17994858611825193 between 0.17287917737789202 stability 0.16066838046272494 performance 0.15938303341902313 band 0.12724935732647816 mechanical 0.10411311053984576 experimental 0.09190231362467867 promising 0.08868894601542417 reveal 0.08419023136246787 stable 0.05719794344473008 enhanced 0.04755784061696658 strong 0.033419023136246784 formation 0.032776349614395885 temperature 0.027634961439588688 optoelectronic 0.01992287917737789 phase 0.017352185089974295 efficient 0.013496143958868894 strategy 0.007069408740359897 design 0.005784061696658098 novel 0.002570694087403599 surface 0.0
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