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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 0.7033997655334114 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 0.3161391168425166 Discover 0.0 Forcite 0.06760453302071122 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 0.6978751660026561 2026 1.0 2027 0.0

Keywords

target 1.0 energy 0.3079767564712097 performance 0.1838351822503962 between 0.16957210776545167 potential 0.16164817749603805 analysis 0.15583729529846804 stability 0.14315900686740624 promising 0.08293713681986266 optical 0.07765451664025357 reveal 0.07395668251452721 band 0.06550449022715267 experimental 0.06550449022715267 efficient 0.060221870047543584 enhanced 0.05916534601162177 adsorption 0.04807184363444268 stable 0.044374009508716325 formation 0.03328050713153724 strategy 0.030110935023771792 mechanical 0.024828314844162706 surface 0.02271526677231907 design 0.01901743264659271 strong 0.01901743264659271 temperature 0.01531959852086635 metal 5.282620179609086E-4 novel 0.0
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