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Application

Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.01406799531066823 Amorphous Cell 0.025009769441187966 Blends 0.0 CASTEP 0.7030089878858929 COMPASS 0.032043767096522076 COMPASS III 0.01797577178585385 COSMOconf 0.0 COSMOperm 0.0 COSMOquick 0.0 COSMOtherm 0.0015631105900742479 Classical Simulations 0.09691285658460336 Conformers 0.0 Crystallization 0.012895662368112544 DFTB Plus 0.0015631105900742479 DMol3 0.31652989449003516 Discover 0.0 Forcite 0.06799531066822978 GULP 0.003907776475185619 Kinetix 3.9077764751856197E-4 Morphology 0.0031262211801484957 ONETEP 0.0015631105900742479 Polymorph 7.815552950371239E-4 QMERA 3.9077764751856197E-4 QSAR 0.0 Quantum Mechanics 1.0 Reflex 0.008206330597889801 Reflex Plus 0.0 Semi-empirical 0.0027354435326299334 Sorption 0.01016021883548261 Synthia 0.0 TURBOMOLE 3.9077764751856197E-4 VAMP 0.0 X-Cell 0.0

Year

2025 0.696748506967485 2026 1.0 2027 0.0

Keywords

target 1.0 energy 0.30761099365750527 performance 0.18181818181818182 between 0.17019027484143764 potential 0.16331923890063424 analysis 0.15644820295983086 stability 0.1427061310782241 promising 0.08298097251585623 optical 0.07716701902748414 reveal 0.07241014799154334 band 0.06501057082452431 experimental 0.06501057082452431 efficient 0.05866807610993657 enhanced 0.057610993657505286 adsorption 0.046511627906976744 stable 0.04439746300211417 formation 0.034355179704016914 strategy 0.02959830866807611 mechanical 0.024841437632135307 surface 0.021670190274841437 strong 0.01849894291754757 design 0.017970401691331923 temperature 0.01638477801268499 novel 5.285412262156448E-4 metal 0.0
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