Abstract
The
advancement
of
acceptors
plays
a
pivotal
role
in
determining
photovoltaic
performance.
While
previous
efforts
have
focused
on
optimizing
acceptor–donor–acceptor
1
–donor–acceptor
(A–DA
–D–A)‐typed
by
adjusting
side
chains,
end
groups,
and
conjugated
extension
the
electron‐deficient
central
A
unit,
systematic
exploration
impact
peripheral
aryl
substitutions,
particularly
with
different
electron
unit
its
influence
device
performance
is
still
lacking.
In
this
study,
three
novel
–
QxTh,
QxPh,
QxPy
distinct
substitutions
quinoxaline
(Qx)
are
designed
synthesized.
Density
functional
theory
(DFT)
analyses
reveal
that
featuring
phenyl‐substituted
Qx,
exhibits
smallest
molecular
binding
energies
tightest
π···π
stacking
distance.
Consequently,
PM6:QxPh
demonstrates
better
power
conversion
efficiency
(PCE)
17.1%
compared
to
blends
incorporating
QxTh
(16.4%)
(15.7%).
This
enhancement
primarily
attributed
suppressed
charge
recombination,
improved
extraction,
more
favorable
morphology.
Importantly,
introducing
QxPh
as
guest
acceptor
into
PM6:BTP‐eC9
binary
system
yields
an
outstanding
PCE
19.5%,
indicating
substantial
potential
advancing
ternary
work
provides
deep
insights
expansion
high‐performance
organic
materials
through
substitution
strategy.
Advanced Functional Materials,
Год журнала:
2024,
Номер
unknown
Опубликована: Ноя. 12, 2024
Abstract
P‐type
carbazole‐derived
self‐assembled
monolayers
(SAMs)
have
garnered
significant
attention
as
promising
hole
transport
layers
(HTLs)
in
the
development
of
highly
efficient
organic
solar
cells
(OSCs).
However,
it
still
lacks
effective
navigation
to
modulate
terminal
functional
groups
SAMs
achieve
a
compromise
between
highest
occupied
molecular
orbital
(HOMO)
energy
levels
and
self‐aggregation
behavior.
Herein,
are
adjusted
three
synthesized,
namely,
t‐Bu‐3PACz,
Ph‐3PACz,
Bz‐3PACz
comprehensively
investigate
their
intrinsic
properties
influence
on
photovoltaic
performance.
Among
them,
Ph‐3PACz
featuring
an
exceptionally
suitable
conjugated
region
steric
hindrance
exhibits
best
compatibility
with
active
layer,
superior
electrical
conductivity,
HOMO
level
aligning
polymer
donor,
ordered
film
packing.
As
result,
devices
based
exhibit
open‐circuit
voltage
(
V
OC
)
0.850
V,
short‐circuit
current
density
J
SC
28.7
mA
cm
−2,
fill
factor
(FF)
78.5%,
thus
resulting
remarkable
power
conversion
efficiency
(PCE)
19.2%.
This
work
provides
easily
navigable
method
packing
SAMs,
thereby
achieving
OSCs.
Abstract
Morphology
control
plays
a
key
role
for
improving
efficiency
and
stability
of
bulk
heterojunctions
(BHJ)
organic
solar
cells
(OSCs).
Halogenation
methoxylation
are
two
separate
ways
successfully
adopted
in
additives
morphology
optimization.
In
this
work,
these
strategies
combined
together.
A
series
halogenated
methoxylated
thiophenes
is
designed
synthesized
as
volatile
to
the
evolution
BHJ
morphology.
Specifically,
addition
2,5‐diiodo‐3,4‐dimethoxythiophene
(MT‐I)
prominently
improves
performance
photostability
OSCs.
Computational
simulations
reveal
noncovalent
interactions
MT‐I
with
active
layer
materials
that
corresponds
inhibition
excessive
aggregation
behavior
PM6
Y6
during
film‐forming
process,
facilitating
favorable
phase
separation
enhanced
molecular
stacking.
Consequently,
PM6:Y6‐based
binary
OSCs
treatment
achieves
high
PCE
17.93%.
Furthermore,
demonstrates
broad
feasibility
across
diverse
high‐efficiency
OSCs,
leading
superior
photovoltaic
(PCE
over
18%).
This
study
offers
valuable
guidance
design
application
high‐performance
future
endeavors.
Advanced Functional Materials,
Год журнала:
2025,
Номер
unknown
Опубликована: Фев. 16, 2025
Abstract
The
electronic
transport
layer
(ETL)
based
on
perylene‐diimide
(PDI)
has
been
widely
demonstrated
for
efficient
organic
solar
cells
(OSCs).
However,
the
effect
of
ETL
materials
interfacial
traps
and
energy
losses
remains
understudied.
This
study
investigates
effects
dipole
distance
PDINN
interface
defects
using
three
specifically
designed
weak
acidic
with
varying
carboxyl
hydroxyl
group
amounts.
Among
these,
3,5‐dihydroxybenzoic
acid
(2OH),
moderate
pH
high
distance,
enhanced
intermolecular
forces
PDINN.
interaction
boosted
π–π
stacking,
ohmic
contact
active
Ag
electrode.
P‐2OH
film
exhibited
a
higher
more
uniform
potential
distribution,
suppressing
charge
recombination
at
interface,
reducing
trap
density
to
2.12
×
10
16
cm
3
,
non‐radiative
loss
∆E
from
0.236
0.174
eV.
Consequently,
decreased
0.553
0.484
meV
PM6:
BTP‐ec9/P‐2OH
device.
Notably,
decent
PCE
19.1%
is
achieved
(10
nm),
it
impressively
power
conversion
efficiency
(PCE)
16.4%
when
thickness
up
50
nm.
work
underscores
importance
groups
in
regulating
minimize
offers
insights
developing
thickness‐insensitive
interlayers
high‐performance
OSCs.
The
widely
used
ZnO
electron
transport
layer
in
inverted
nonfullerene
organic
solar
cells
(nf‐OSCs)
offers
advantages
such
as
excellent
mobility
and
optical
transparency.
However,
challenges
arise
from
surface
defects
solution‐processed
ZnO,
where
oxygen‐containing
can
penetrate
the
photoactive
layer,
leading
to
photocatalytic
reactions
with
acceptors
under
UV
light,
thereby
compromising
device
stability.
Another
challenge
is
that
most
recent
high‐efficiency
nf‐OSCs
employ
conventional
structures,
while
structures
exhibit
comparatively
lower
performance.
To
develop
stable
high‐performance
nf‐OSCs,
interface
modification
essential
mitigate
issues
enhance
relatively
power
conversion
efficiency
(PCE).
overcome
these
limitations,
we
introduce
bathophenanthroline
(BPhen)
doped
Cs
2
CO
3
.
BPhen:Cs
creates
suitable
energy
levels,
enhancing
reducing
charge
recombination.
This
approach
significantly
improves
current
density
fill
factor,
resulting
a
notable
enhancement
PCE
of
pristine
devices
15.54%
17.09%
PM6:Y6
nf‐OSCs.
Furthermore,
ZnO/BPhen:Cs
stability,
retaining
~83%
their
initial
even
after
1000
h
without
encapsulation,
showcasing
superior
stability
compared
ZnO‐based
devices.
Advanced Optical Materials,
Год журнала:
2025,
Номер
unknown
Опубликована: Апрель 19, 2025
Abstract
Perylene
diimides
(PDIs)
have
emerged
as
promising
materials
for
cathode
interfacial
layers
(CILs)
in
organic
solar
cells
(OSCs)
due
to
their
advantageous
energy
level
alignment
with
active
layer
and
insensitivity
film
thickness,
enabling
the
easy
fabrication
of
efficient
large‐area
devices.
However,
inherent
low
dipole
moment
PDIs
results
suboptimal
charge
transport
properties,
limiting
device
performance.
Herein,
a
new
strategy
by
incorporating
trifluoroacetic
acid
(TFA)
into
PDI
material
fabricate
compound
large
number
moments
is
introduced.
Density
functional
theory
calculations
reveal
that
highly
electronegative
F
groups
attract
ammonium
end
PDIN
significantly
increase
from
0.3
2.6
Debye,
enhancing
transfer
OSCs.
By
optimizing
TFA
concentration
2%
using
CILs,
champion
efficiencies
18.0%
19.5%
are
achieved
state‐of‐the‐art
binary
comprising
PM6:Y6
PM6:L8‐BO
(Layer‐by‐Layer),
respectively.
Notably,
these
devices
maintain
88.3%
initial
efficiency
after
240
h,
demonstrating
exceptional
operational
stability.
The
work
shows
F‐induced
adsorbed
not
only
provides
mechanism
design
but
also
paves
way
achieving
high‐efficiency
stable
ACS Applied Materials & Interfaces,
Год журнала:
2025,
Номер
unknown
Опубликована: Апрель 22, 2025
Regulating
aggregation
and
molecular
packing
of
small-molecule
cathode
interlayer
(CIL)
materials
is
a
significant
but
imperceptible
issue
in
the
development
high-performance
organic
solar
cells
(OSCs).
For
celebrity
PDINN
small
molecule,
strong
tendency
perylene
diimide
backbone
leads
to
excessive
crystallinity
when
films
form,
ultimately
affecting
morphology
charge
transport
ability
films.
Herein,
we
address
this
by
developing
hydroxyl-induced
anti-aggregation
strategy
introducing
suitable
amount
hydroxypropyl
cellulose
(HPC)
into
solution
PDINN,
careful
balance
achieved
between
film-forming
quality
material.
Taking
two
commercially
available
active
layer
systems,
PM6/Y6
D18/L8-BO,
as
examples,
introduction
HPC
significantly
increases
JSC
FF
values
devices.
Therefore,
power
conversion
efficiency
risen
from
17.38%
18.25%
for
system
18.45%
19.73%
D18/L8-BO
system,
it
was
proved
that
thickness
tolerance
hybrid
interface
improved
significantly.
This
has
demonstrated
other
systems.
work
provides
simple
effective
method
solve
problem
molecule
CIL
materials,
which
conducive
commercial
OSCs.
Advanced Functional Materials,
Год журнала:
2025,
Номер
unknown
Опубликована: Май 19, 2025
Abstract
Cathode
interface
engineering
is
a
critical
strategy
for
enhancing
power
conversion
efficiency
and
device
stability
in
semitransparent
organic
photovoltaics
(STOPVs).
Herein,
novel
approach
of
using
trithiocyanuric
acid
trisodium
salt
(TATS)
proposed
to
strengthen
the
chemical
interactions
between
cathode
interlayer
(CIL)
ultrathin
silver
(Ag)
electrode.
The
introduction
TATS
not
only
improves
conductivity
CIL,
but
also
promotes
growth
Ag
electrodes
stabilizes
morphology
films,
thus
simultaneously
improving
light
utilization
(LUE)
photostability
STOPVs.
LUE
STOPVs
improved
from
3.62%
3.98%
after
modification
with
TATS,
further
enhanced
4.30%
by
35
nm
molybdenum
oxide
as
optical
structure.
In
addition,
significantly
retention
rate
initial
53%
85%,
200
h
continuous
illumination.
This
study
offers
new
perspective
on
achieving
high‐efficiency
through
CIL
strategy.
Advanced Functional Materials,
Год журнала:
2024,
Номер
unknown
Опубликована: Дек. 26, 2024
Abstract
Cathode
interface
layers
(CILs)
are
crucial
for
optimizing
the
power
conversion
efficiency
(PCE)
and
stability
of
organic
solar
cells
(OSCs).
Two
small
molecule
CILs,
PDINN‐TS
PDINN‐BS
developed,
by
modifying
bay
sites
perylene
diimide
(PDI)
with
thieno
[3,2‐b]
thiophene
2,2′‐bithiophene,
separately.
Due
to
better
electron‐donating
capacity
longer
conjugate
length
exhibits
a
stronger
self‐doping
effect
superior
compatibility
compared
PDINN‐TS.
Consequently,
in
PM6:
Y6
OSCs,
achieved
an
elevated
PCE
16.95%,
surpassing
16.66%.
Meanwhile,
excellent
universality.
When
employing
BTP‐eC9
PM6:L8‐BO
systems,
PDINN‐BS‐based
device
yielded
18.02%
18.95%,
outperforming
17.51%
18.38%,
respectively.
Furthermore,
tests
revealed
that
after
being
stored
glovebox
1500
h,
retained
90%
its
pristine
PCE,
86%
showed
80%
decay
(T
80
)
150
h
air,
200
at
70
°C
heating
N
2
,
500
under
1
sun
immersion,
120,
130,
380
This
demonstrates
displayed
complicated
environment.
this
study
provides
significative
guidance
exploitation
high‐performance
high‐stability
OSCs.