Chemistry of Materials,
Journal Year:
2020,
Volume and Issue:
32(21), P. 9176 - 9189
Published: Oct. 19, 2020
The
polymer
binders
used
in
most
lithium-ion
batteries
(LIBs)
serve
only
a
structural
role,
but
there
are
exciting
opportunities
to
increase
performance
by
using
polymers
with
combined
electronic
and
ionic
conductivity.
To
this
end,
here
we
examine
dihexyl-substituted
poly(3,4-propylenedioxythiophene)
(PProDOT-Hx2)
as
an
electrochemically
stable
π-conjugated
that
becomes
electrically
conductive
(up
0.1
S
cm–1)
upon
electrochemical
doping
the
potential
range
of
3.2
4.5
V
(vs
Li/Li+).
Because
family
is
easy
functionalize,
can
be
effectively
fabricated
into
electrodes,
shows
mixed
conductivity,
PProDOT-Hx2
promise
for
replacing
insulating
polyvinylidene
fluoride
(PVDF)
commonly
commercial
LIBs.
A
experimental
theoretical
study
presented
establish
fundamental
conductivity
PProDOT-Hx2.
Electrochemical
kinetics
electron
spin
resonance
first
verify
readily
doped
chemically
interest
cathode
materials.
novel
impedance
method
then
directly
follow
evolution
both
function
potential.
Both
values
stay
high
across
interest.
combination
optical
ellipsometry
grazing
incidence
wide
angle
X-ray
scattering
characterize
solvent
swelling
changes
occur
during
doping.
These
results
calibrate
molecular
dynamics
simulations,
which
show
improved
swelling.
Simulations
further
attribute
its
open
morphology
increased
solvation
possible
because
oxygen-containing
propylenedioxythiophene
backbone.
Finally,
binder
well-known
LiNi0.8Co0.15Al0.05O2
relative
PVDF
presented.
PProDOT-Hx2-based
cells
display
fivefold
capacity
at
rates
discharge
compared
PVDF-based
electrodes
also
long-term
cycling
stability.
rate
capability
stability
demonstrate
benefits
such
PProDOT-Hx2,
good
over
standard
operation.
Angewandte Chemie International Edition,
Journal Year:
2018,
Volume and Issue:
58(13), P. 4129 - 4142
Published: Nov. 5, 2018
Abstract
For
over
two
decades
bulk‐heterojunction
polymer
solar
cell
(BHJ‐PSC)
research
was
dominated
by
donor:acceptor
BHJ
blends
based
on
donors
and
fullerene
molecular
acceptors.
This
situation
has
changed
recently,
with
non‐fullerene
PSCs
developing
very
rapidly.
The
power
conversion
efficiencies
of
have
now
reached
15
%,
which
is
far
above
the
most
efficient
fullerene‐based
PSCs.
Among
various
PSCs,
all‐polymer
cells
(APSCs)
donor‐polymer
acceptor
BHJs
attracted
growing
attention,
due
to
following
attractions:
1)
large
tunable
light
absorption
donor/polymer
pair;
2)
robustness
film
morphology;
3)
compatibility
scale/large
area
manufacturing;
4)
long‐term
stability
external
environmental
mechanical
stresses.
Minireview
highlights
opportunities
offered
APSCs,
selected
families
suitable
for
these
devices
optimization
enhance
performance
further,
discusses
challenges
facing
APSC
development
commercial
applications.
Journal of the American Chemical Society,
Journal Year:
2020,
Volume and Issue:
142(34), P. 14532 - 14547
Published: July 23, 2020
Emerging
nonfullerene
acceptors
(NFAs)
with
crystalline
domains
enable
high-performance
bulk
heterojunction
(BHJ)
solar
cells.
Thermal
annealing
is
known
to
enhance
the
BHJ
photoactive
layer
morphology
and
performance.
However,
microscopic
mechanism
of
annealing-induced
performance
enhancement
poorly
understood
in
emerging
NFAs,
especially
regarding
competing
factors.
Here,
optimized
thermal
model
system
PBDB-TF:Y6
(Y6
=
2,2'-((2Z,2'Z)-((12,13-bis(2-ethylhexyl)-3,9-diundecyl-12,13-dihydro-[1,2,5]thiadiazolo[3,4-e]thieno[2″,3'':4',5']thieno[2',3':4,5]pyrrolo[3,2-g]thieno[2',3':4,5]-thieno[3,2-b]indole-2,10-diyl)bis(methanylylidene))bis(5,6-difluoro-3-oxo-2,3-dihydro-1H-indene-2,1-diylidene))dimalononitrile)
decreases
open
circuit
voltage
(VOC)
but
increases
short
current
(JSC)
fill
factor
(FF)
such
that
resulting
power
conversion
efficiency
(PCE)
from
14
15%
ambient
environment.
Here
we
systematically
investigate
these
effects
through
in-depth
characterizations
carrier
mobility,
film
morphology,
charge
photogeneration,
recombination
using
SCLC,
GIXRD,
AFM,
XPS,
NEXAFS,
R-SoXS,
TEM,
STEM,
fs/ns
TA
spectroscopy,
2DES,
impedance
spectroscopy.
Surprisingly,
does
not
alter
crystallinity,
R-SoXS
characteristic
size
scale,
relative
average
phase
purity,
or
TEM-imaged
separation
rather
facilitates
Y6
migration
top
surface,
changes
PBDB-TF/Y6
vertical
intermixing,
reduces
bottom
surface
roughness.
While
increase
bimolecular
(BR)
lower
free
(FC)
yield,
they
also
electron
hole
mobility
by
at
least
2-fold.
Importantly,
increased
μh
dominates
underlies
FF
PCE.
Single-crystal
X-ray
diffraction
reveals
molecules
cofacially
pack
via
their
end
groups/cores,
shortest
π-π
distance
as
close
3.34
Å,
clarifying
out-of-plane
π-face-on
molecular
orientation
nanocrystalline
domains.
DFT
analysis
crystals
hole/electron
reorganization
energies
low
160/150
meV,
large
intermolecular
electronic
coupling
integrals
12.1-37.9
meV
rationalizing
3D
transport,
relatively
high
μe
10-4
cm2
V-1
s-1.
Taken
together,
this
work
clarifies
richness
high-efficiency
NFA
cells
tasks
for
future
materials
design.
Green Chemistry,
Journal Year:
2022,
Volume and Issue:
24(5), P. 1809 - 1894
Published: Jan. 1, 2022
A
comprehensive
and
critical
overview
of
the
sustainable
strategies
for
direct
C–H
bond
arylation
(hetero)arenes,
based
on
use
recoverable
catalysts,
solvents
non-conventional
energy
sources,
has
been
performed.
ACS Materials Letters,
Journal Year:
2020,
Volume and Issue:
2(8), P. 951 - 974
Published: June 29, 2020
The
activation
of
typically
unreactive
aromatic
C–H
bonds
by
transition-metal
catalysis
has
been
receiving
increased
attention
from
the
synthetic
chemistry
community
in
recent
years.
Advances
this
area
have
enabled
direct
and
site-selective
modification
rings
without
need
for
pre-functionalization.
Accordingly,
these
techniques
found
broad
application
many
fields,
including
construction
extended
π-systems
use
materials
science.
This
review
will
discuss
reports
reactions
applied
toward
synthesis
π-extended
functional
materials.