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Application

Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.007602153943617358 Amorphous Cell 0.0064407137577869285 CASTEP 1.0 COMPASS 0.012987012987012988 COMPASS III 0.0029563932002956393 COSMOperm 0.0 COSMOquick 0.0 COSMOtherm 1.0558547143912998E-4 Classical Simulations 0.04392355611867807 Conformers 2.1117094287825995E-4 Crystallization 0.011192059972547777 DFTB Plus 0.0017949530144652096 DMol3 0.0355823038749868 Discover 3.167564143173899E-4 Forcite 0.024812585788195545 GULP 0.004540175271882589 Kinetix 0.0 Morphology 0.0024284658430999894 ONETEP 0.0015837820715869496 Polymorph 6.335128286347799E-4 QMERA 2.1117094287825995E-4 Quantum Mechanics 1.0 Reflex 0.008130081300813009 Reflex Plus 2.1117094287825995E-4 Semi-empirical 0.0022172949002217295 Sorption 0.0033787350860521592 VAMP 0.0 X-Cell 2.1117094287825995E-4

Year

2019 4.5454545454545455E-4 2020 0.01818181818181818 2021 0.39 2022 0.6427272727272727 2023 0.8095454545454546 2024 0.9627272727272728 2025 1.0 2026 0.4777272727272727 2027 0.0

Keywords

target 1.0 energy 0.2804676578980811 between 0.17168636421400432 optical 0.1638073452789427 band 0.14817638835938493 potential 0.11742279832253145 stability 0.10522302706824246 experimental 0.10166476045240819 analysis 0.09226077011056043 performance 0.08095056551023001 stable 0.060236370568051846 mechanical 0.05744058965561062 surface 0.045622061253018174 crystal 0.03901385182361164 promising 0.036345151861735925 phase 0.018553818782564492 temperature 0.013851823611640616 higher 0.012708095056551023 formation 0.012453933155420002 chemical 0.0111831236497649 novel 0.006862371330537552 well 0.006862371330537552 adsorption 1.2708095056551024E-4 strong 1.2708095056551024E-4 reveal 0.0
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