Rydberg transitions as a probe for structural changes and phase transition at polymer surfaces: an ATR-FUV-DUV and quantum chemical study of poly(3-hydroxybutyrate) and its nanocomposite with graphene

2018 ◽  
Vol 20 (13) ◽  
pp. 8859-8873 ◽  
Author(s):  
Krzysztof B. Beć ◽  
Yusuke Morisawa ◽  
Kenta Kobashi ◽  
Justyna Grabska ◽  
Ichiro Tanabe ◽  
...  
Keyword(s):  
Phase Transition ◽  
Quantum Chemical ◽  
Structural Changes ◽  
Quantum Chemical Study ◽  
Chemical Study ◽  
Polymer Surfaces ◽  
Quantum Mechanical ◽  
Quantum Mechanical Calculations ◽  
Rydberg Transitions

ATR-FUV-DUV (145–300 nm; 8.55–4.13 eV) and quantum mechanical calculations study of PHB and its nanocomposite with graphene.

scholarly journals Rational design of nanosystems for simultaneous drug delivery and photodynamic therapy by quantum mechanical modeling

Nanoscale ◽  
2019 ◽  
Vol 11 (33) ◽  
pp. 15576-15588 ◽  
Author(s):  
Moloud Kaviani ◽  
Cristiana Di Valentin
Keyword(s):  
Drug Delivery ◽  
Photodynamic Therapy ◽  
Quantum Chemical ◽  
Rational Design ◽  
Quantum Chemical Study ◽  
Chemical Study ◽  
Quantum Mechanical ◽  
Mechanical Modeling

Multiscale quantum chemical study of dopamine-functionalized TiO2 nanoparticles loaded by doxorubicin with applications in drug delivery and photodynamic therapy.

Quantum chemical study and low-temperature calorimetry of phase transition in V4S9Br4

2008 ◽  
Vol 181 (10) ◽  
pp. 2877-2881 ◽  
Author(s):  
S.G. Kozlova ◽  
S.P. Gabuda ◽  
G.A. Berezovskii ◽  
D.P. Pischur ◽  
Y.V. Mironov ◽  
...  
Keyword(s):  
Phase Transition ◽  
Low Temperature ◽  
Quantum Chemical ◽  
Quantum Chemical Study ◽  
Chemical Study ◽  
Low Temperature Calorimetry

A quantum chemical study of the acidity of acetylene and 1,2-dihydrobuckminsterfullerene de-rivatives

2018 ◽  
Vol 59 (1) ◽  
pp. 51-53
Author(s):  
M. V. Makarova ◽  
◽  
S. G. Semenov ◽  
R. R. Kostikov ◽  
◽  
...  
Keyword(s):  
Quantum Chemical ◽  
Quantum Chemical Study ◽  
Chemical Study
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