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Application

Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.011726384364820847 Amorphous Cell 0.02736156351791531 Blends 0.0 CASTEP 0.6885993485342019 COMPASS 0.036482084690553744 COMPASS III 0.016938110749185668 COSMOconf 0.0 COSMOperm 0.0 COSMOtherm 6.514657980456026E-4 Classical Simulations 0.1022801302931596 Conformers 0.0 Crystallization 0.014332247557003257 DFTB Plus 6.514657980456026E-4 DMol3 0.32964169381107494 Discover 0.0 Forcite 0.07166123778501629 GULP 0.004560260586319218 Kinetix 0.0 Morphology 0.003908794788273616 ONETEP 0.001954397394136808 Polymorph 0.0013029315960912053 QMERA 6.514657980456026E-4 QSAR 0.0 Quantum Mechanics 1.0 Reflex 0.008469055374592834 Reflex Plus 0.0 Semi-empirical 0.0026058631921824105 Sorption 0.008469055374592834 Synthia 0.0 TURBOMOLE 0.0 VAMP 0.0

Year

2025 0.1338757396449704 2026 1.0 2027 0.0

Keywords

target 1.0 energy 0.3522072936660269 performance 0.20825335892514396 between 0.190978886756238 analysis 0.18809980806142035 stability 0.16602687140115163 potential 0.16506717850287908 promising 0.1238003838771593 efficient 0.10460652591170826 reveal 0.09788867562380038 optical 0.09117082533589252 experimental 0.07965451055662189 enhanced 0.07677543186180422 stable 0.07485604606525911 band 0.07389635316698656 strategy 0.06525911708253358 formation 0.06429942418426103 adsorption 0.061420345489443376 strong 0.05470249520153551 mechanical 0.036468330134357005 temperature 0.03358925143953935 surface 0.03166986564299424 design 0.01727447216890595 metal 0.01055662188099808 novel 0.0
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