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Application

Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.012078152753108348 Amorphous Cell 0.028419182948490232 Blends 7.104795737122557E-4 CASTEP 0.7037300177619893 COMPASS 0.03978685612788632 COMPASS III 0.011367673179396092 COSMOconf 0.0 COSMOperm 0.0 COSMOquick 0.0 COSMOtherm 0.0021314387211367673 Classical Simulations 0.09769094138543517 Conformers 3.5523978685612787E-4 Crystallization 0.012788632326820605 DFTB Plus 7.104795737122557E-4 DMol3 0.314031971580817 DPD 0.0 Discover 7.104795737122557E-4 Forcite 0.06927175843694494 GULP 0.002841918294849023 Mesocite 0.0 Mesoscale 0.0 Morphology 0.003197158081705151 ONETEP 0.0014209591474245115 Polymorph 7.104795737122557E-4 QMERA 3.5523978685612787E-4 Quantum Mechanics 1.0 Reflex 0.00852575488454707 Reflex Plus 0.0 Semi-empirical 0.0021314387211367673 Sorption 0.007815275310834813 TURBOMOLE 0.0014209591474245115 VAMP 3.5523978685612787E-4 X-Cell 3.5523978685612787E-4

Year

2024 0.34595300261096606 2025 1.0 2026 0.489556135770235 2027 0.0

Keywords

target 1.0 energy 0.2885662431941924 between 0.16787658802177857 potential 0.16152450090744103 performance 0.1483666061705989 stability 0.12295825771324864 analysis 0.11842105263157894 optical 0.08484573502722323 experimental 0.073502722323049 band 0.06941923774954628 promising 0.06215970961887477 adsorption 0.048548094373865695 surface 0.04582577132486389 stable 0.0426497277676951 efficient 0.04128856624319419 enhanced 0.03130671506352087 formation 0.02132486388384755 reveal 0.01678765880217786 mechanical 0.015426497277676952 novel 0.010889292196007259 temperature 0.007713248638838476 design 0.0027223230490018148 chemical 4.5372050816696913E-4 higher 4.5372050816696913E-4 strong 0.0
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