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Application
Materials Studio
1.0
Solvation Chemistry
0.0
Modules
Adsorption Locator
0.01375214877324582
Amorphous Cell
0.023284888263791218
Blends
4.6882325363338024E-4
CASTEP
0.7001093920925144
COMPASS
0.0379746835443038
COMPASS III
0.01328332551961244
COSMOconf
1.562744178777934E-4
COSMOperm
1.562744178777934E-4
COSMOquick
0.0
COSMOtherm
0.001562744178777934
Cantera
0.0
Classical Simulations
0.0948585716518206
Conformers
1.562744178777934E-4
Crystallization
0.012345679012345678
DFTB Plus
0.0026566651039224877
DMol3
0.32192530082825443
Discover
6.250976715111736E-4
Forcite
0.06438506016565089
GULP
0.003438037193311455
Kinetix
3.125488357555868E-4
Mesocite
0.0
Mesoscale
0.0
Morphology
0.0028129395218002813
ONETEP
0.0021878418502891076
Polymorph
9.376465072667605E-4
QMERA
3.125488357555868E-4
QSAR
1.562744178777934E-4
Quantum Mechanics
1.0
Reflex
0.008438818565400843
Reflex Plus
1.562744178777934E-4
Semi-empirical
0.0035943116111892483
Sorption
0.010314111579934365
Synthia
4.6882325363338024E-4
TURBOMOLE
7.81372089388967E-4
VAMP
3.125488357555868E-4
X-Cell
3.125488357555868E-4
Year
2020
0.0
2023
0.09248170326014638
2024
0.5312707917498337
2025
1.0
2026
0.5033266799733865
2027
0.0
Keywords
target
1.0
energy
0.29482861105607294
between
0.17852189419457104
potential
0.15692490588468397
performance
0.13968694273826035
stability
0.11610857935407172
analysis
0.11591044184664157
optical
0.08718050326926888
band
0.07390529027144839
experimental
0.07212205270457697
promising
0.05706360213988508
adsorption
0.048939964335248665
efficient
0.03744798890429958
surface
0.03744798890429958
stable
0.03625916385971865
enhanced
0.025361600951060034
formation
0.019219338220725184
novel
0.013275212997820487
reveal
0.012878937982960175
mechanical
0.012086387953239549
temperature
0.008718050326926888
chemical
0.0049534376857539135
metal
0.0035664751337428175
design
0.0
strong
0.0
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