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Application

Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.007274686784319009 Amorphous Cell 0.006601104674659841 CASTEP 1.0 COMPASS 0.012932776505456016 COMPASS III 0.003367910548295837 COSMOperm 0.0 COSMOquick 0.0 COSMOtherm 0.0 Classical Simulations 0.04364812070591405 Conformers 2.69432843863667E-4 Crystallization 0.011989761551933181 DFTB Plus 0.0017513134851138354 DMol3 0.03421797117068571 Discover 1.347164219318335E-4 Forcite 0.02519197090125286 GULP 0.004445641923750505 Kinetix 0.0 Morphology 0.0025596120167048365 ONETEP 0.0014818806412501683 Polymorph 6.735821096591674E-4 QMERA 2.69432843863667E-4 Quantum Mechanics 1.0 Reflex 0.008756567425569177 Reflex Plus 1.347164219318335E-4 Semi-empirical 0.002155462750909336 Sorption 0.003367910548295837 X-Cell 2.69432843863667E-4

Year

2021 0.06363636363636363 2022 0.40045454545454545 2023 0.47 2024 0.9595454545454546 2025 1.0 2026 0.4777272727272727 2027 0.0

Keywords

target 1.0 energy 0.2873299459105065 between 0.17603671529257497 optical 0.17538108506802164 band 0.14784461563678086 potential 0.13964923782986396 stability 0.11850516308801835 analysis 0.10883461727585642 experimental 0.10342566792329126 performance 0.09818062612686444 mechanical 0.06752991312899524 stable 0.059498442878216685 promising 0.05146697262743812 surface 0.03950172102933945 crystal 0.03737092279954106 formation 0.01540731027700377 phase 0.015079495164727093 higher 0.014751680052450419 chemical 0.013932142271758728 novel 0.013932142271758728 temperature 0.013440419603343714 reveal 0.00885100803147025 strong 0.005408949352565153 enhanced 0.005245041796426815 adsorption 0.0
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