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Application

Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.011723329425556858 Amorphous Cell 0.025009769441187966 Blends 0.0 CASTEP 0.6979288784681517 COMPASS 0.032825322391559206 COMPASS III 0.017584994138335287 COSMOconf 3.9077764751856197E-4 COSMOperm 0.0 COSMOtherm 0.0015631105900742479 Classical Simulations 0.09691285658460336 Conformers 0.0 Crystallization 0.011723329425556858 DFTB Plus 0.0015631105900742479 DMol3 0.32200078155529505 Discover 0.0 Forcite 0.0687768659632669 GULP 0.0035169988276670576 Kinetix 3.9077764751856197E-4 Morphology 0.0023446658851113715 ONETEP 0.0019538882375928096 Polymorph 0.0011723329425556857 QMERA 3.9077764751856197E-4 QSAR 0.0 Quantum Mechanics 1.0 Reflex 0.007815552950371238 Reflex Plus 0.0 Semi-empirical 0.0027354435326299334 Sorption 0.010550996483001172 Synthia 0.0 TURBOMOLE 3.9077764751856197E-4 VAMP 0.0

Year

2025 0.7058038692461641 2026 1.0 2027 0.0

Keywords

target 1.0 energy 0.31470743278861363 performance 0.19030047443331577 between 0.17659462308908802 potential 0.1639430680021086 analysis 0.15761729045861886 stability 0.14022140221402213 promising 0.08697944122298366 optical 0.07380073800738007 experimental 0.07221929362150764 reveal 0.07221929362150764 band 0.06589351607801792 efficient 0.05798629414865577 adsorption 0.05693199789140749 enhanced 0.05113336847654191 stable 0.048497627833421195 formation 0.02952029520295203 strategy 0.028465998945703744 strong 0.024775962045334738 mechanical 0.02161307327358988 surface 0.020031628887717447 temperature 0.017923036373220874 design 0.016341591987348445 metal 0.002635740643120717 novel 0.0
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