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Application
Materials Studio
1.0
Solvation Chemistry
0.0
Modules
Adsorption Locator
0.007366893626520817
Amorphous Cell
0.006362317222904342
CASTEP
1.0
COMPASS
0.012613014845406853
COMPASS III
0.003125348811251256
COSMOperm
0.0
COSMOquick
0.0
COSMOtherm
0.0
Classical Simulations
0.04364326375711575
Conformers
2.2323920080366113E-4
Crystallization
0.01194329724299587
DFTB Plus
0.001562674405625628
DMol3
0.0347136957249693
Discover
1.1161960040183056E-4
Forcite
0.024779551289206385
GULP
0.004688023216876884
Kinetix
0.0
Morphology
0.0026788704096439337
ONETEP
0.0014510548052237974
Polymorph
5.580980020091528E-4
QMERA
2.2323920080366113E-4
Quantum Mechanics
1.0
Reflex
0.008817948431744615
Reflex Plus
2.2323920080366113E-4
Semi-empirical
0.0018975332068311196
Sorption
0.0032369684116530864
X-Cell
2.2323920080366113E-4
Year
2019
4.5454545454545455E-4
2021
0.06409090909090909
2022
0.7540909090909091
2023
0.81
2024
0.9627272727272728
2025
1.0
2026
0.4777272727272727
2027
0.0
Keywords
target
1.0
energy
0.2801613987895091
between
0.17350369872225957
optical
0.16583725622057835
band
0.14673839946200404
potential
0.1218560860793544
stability
0.11028917283120376
experimental
0.1031607262945528
analysis
0.09576328177538669
performance
0.08755884330867518
mechanical
0.06039004707464694
stable
0.06025554808338938
surface
0.04465366509751177
promising
0.04075319435104237
crystal
0.040215198386012105
phase
0.01694687289845326
temperature
0.01546738399462004
higher
0.014660390047074647
formation
0.014391392064559515
chemical
0.013449899125756557
novel
0.010087424344317418
well
0.004034969737726967
reveal
0.0036314727639542702
strong
0.002151983860121049
adsorption
0.0
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