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Application
Materials Studio
1.0
Solvation Chemistry
0.0
Modules
Adsorption Locator
0.012504884720593983
Amorphous Cell
0.023055881203595155
Blends
3.9077764751856197E-4
CASTEP
0.7026182102383743
COMPASS
0.03673309886674482
COMPASS III
0.012504884720593983
COSMOperm
0.0
COSMOquick
0.0
COSMOtherm
3.9077764751856197E-4
Classical Simulations
0.09456819069949199
Crystallization
0.013677217663149667
DFTB Plus
0.0015631105900742479
DMol3
0.3216100039077765
Discover
0.0
Forcite
0.06486908948808129
GULP
0.0027354435326299334
Kinetix
0.0
Mesocite
0.0
Mesoscale
0.0
Morphology
0.0027354435326299334
ONETEP
7.815552950371239E-4
Polymorph
0.0011723329425556857
QMERA
0.0
QSAR
0.0
Quantum Mechanics
1.0
Reflex
0.009769441187964049
Reflex Plus
3.9077764751856197E-4
Semi-empirical
0.0023446658851113715
Sorption
0.011723329425556858
Synthia
3.9077764751856197E-4
TURBOMOLE
0.0
VAMP
0.0
X-Cell
3.9077764751856197E-4
Year
2024
0.0
2025
1.0
2026
0.375
Keywords
target
1.0
energy
0.3149171270718232
between
0.18031140130587645
potential
0.17980914113510799
performance
0.16926167754897037
stability
0.1401305876443998
analysis
0.1245605223505776
optical
0.10045203415369161
band
0.09090909090909091
promising
0.08488196885986941
experimental
0.077850326469111
efficient
0.06378704168759418
adsorption
0.06027122049221497
enhanced
0.045705675539929685
reveal
0.03917629331993973
formation
0.03214465092918132
mechanical
0.03164239075841286
stable
0.03063787041687594
surface
0.02862882973380211
temperature
0.023606228026117528
novel
0.01808136614766449
design
0.013561024610748368
strong
0.007031642390758413
strategy
0.0045203415369161224
higher
0.0
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