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Application
Materials Studio
1.0
Solvation Chemistry
0.0
Modules
Adsorption Locator
0.007478513226922647
Amorphous Cell
0.006250697622502512
CASTEP
1.0
COMPASS
0.013059493247014175
COMPASS III
0.003125348811251256
COSMOperm
0.0
COSMOquick
0.0
COSMOtherm
0.0
Classical Simulations
0.04364326375711575
Conformers
2.2323920080366113E-4
Crystallization
0.011161960040183057
DFTB Plus
0.001785913606429289
DMol3
0.03527179372697846
Discover
1.1161960040183056E-4
Forcite
0.024667931688804556
GULP
0.004688023216876884
Kinetix
0.0
Morphology
0.002567250809242103
ONETEP
0.0016742940060274585
Polymorph
4.4647840160732226E-4
QMERA
2.2323920080366113E-4
Quantum Mechanics
1.0
Reflex
0.008259850429735462
Reflex Plus
2.2323920080366113E-4
Semi-empirical
0.0021207724076347805
Sorption
0.0032369684116530864
X-Cell
2.2323920080366113E-4
Year
2019
4.5454545454545455E-4
2021
0.19272727272727272
2022
0.6263636363636363
2023
0.8090909090909091
2024
0.9627272727272728
2025
1.0
2026
0.4777272727272727
2027
0.0
Keywords
target
1.0
energy
0.28170338527673294
between
0.17141321869962386
optical
0.16389038151531435
band
0.14575497044599678
potential
0.123052122514777
stability
0.1090811391724879
experimental
0.10048361096184846
analysis
0.09511015583019881
performance
0.0853036002149382
stable
0.06327243417517464
mechanical
0.05803331542181623
surface
0.048226759806555615
promising
0.03922622246104245
crystal
0.03721117678667383
phase
0.018269747447608814
formation
0.017060720042987643
chemical
0.01491133799032778
temperature
0.014508328855454057
higher
0.01168726491133799
novel
0.008731864588930683
well
0.006448146157979581
reveal
0.003089736700698549
strong
0.0012090274046211713
adsorption
0.0
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