Author Archive

Aromaticity, electron delocalisation, and related molecular properties themed issue out now!

We are delighted to announce that the PCCP themed issue on Aromaticity, electron delocalisation, and related molecular properties has now been published online – take a look today!

The issue was Guest Edited by Professor Dage Sundholm of the University of Helsinki.

The Aromaticity, electron delocalisation, and related molecular properties  themed issue features a broad range of papers and Communications and includes the following Perspective articles:

Take a look at the issue today!

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Top Ten most-read PCCP articles in October

This month sees the following articles in PCCP that are in the top ten most accessed in October:

Crystal growth simulations of methane hydrates in the presence of silica surfaces
Shuai Liang, Dmitri Rozmanov and Peter G. Kusalik
Phys. Chem. Chem. Phys., 2011, 13, 19856-19864
DOI: 10.1039/c1cp21810g

Supported Ru catalysts prepared by two sonication-assisted methods for preferential oxidation of CO in H2
Nina Perkas, Jaclyn Teo, Shoucang Shen, Zhan Wang, James Highfield, Ziyi Zhong and Aharon Gedanken
Phys. Chem. Chem. Phys., 2011, 13, 15690-15698
DOI: 10.1039/c1cp21870k

Solving the spectroscopic phase: imaging excited wave packets and extracting excited state potentials from fluorescence data
Xuan Li, Cian Menzel-Jones, David Avisar and Moshe Shapiro
Phys. Chem. Chem. Phys., 2010, 12, 15760-15765
DOI: 10.1039/c0cp01417f

Graphene-based electrochemical energy conversion and storage: fuel cells, supercapacitors and lithium ion batteries
Junbo Hou, Yuyan Shao, Michael W. Ellis, Robert B. Moore and Baolian Yi
Phys. Chem. Chem. Phys., 2011, 13, 15384-15402
DOI: 10.1039/c1cp21915d

Graphene and carbon nanotube composite electrodes for supercapacitors with ultra-high energy density
Qian Cheng, Jie Tang, Jun Ma, Han Zhang, Norio Shinya and Lu-Chang Qin
Phys. Chem. Chem. Phys., 2011, 13, 17615-17624
DOI: 10.1039/c1cp21910c

Physics and chemistry of water and ice  – Editorial
Carlos Vega, Jose Luis F. Abascal and Pablo G. Debenedetti
Phys. Chem. Chem. Phys., 2011, 13, 19660-19662
DOI: 10.1039/c1cp90177j

Density functional theory for transition metals and transition metal chemistry
Christopher J. Cramer and Donald G. Truhlar
Phys. Chem. Chem. Phys., 2009, 11, 10757-10816
DOI: 10.1039/b907148b

Physics and Chemistry of Cold Molecules  – Editorial
Olivier Dulieu, Roman Krems, Matthias Weidemüller and Stefan Willitsch
Phys. Chem. Chem. Phys., 2011, 13, 18703-18704
DOI: 10.1039/c1cp90157e

Layer-by-layer assembly as a versatile bottom-up nanofabrication technique for exploratory research and realistic application
Katsuhiko Ariga, Jonathan P. Hill and Qingmin Ji
Phys. Chem. Chem. Phys., 2007, 9, 2319-2340
DOI: 10.1039/b700410a

Colloidal metal nanoparticles as a component of designed catalyst
Chun-Jiang Jia and Ferdi Schüth
Phys. Chem. Chem. Phys., 2011, 13, 2457-2487
DOI: 10.1039/c0cp02680h

Why not take a look at the articles today and blog your thoughts and comments below.

Fancy submitting an article to PCCP? Then why not submit to us today!

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Physics and chemistry of water and ice themed issue out now!

We are delighted to announce that the PCCP themed issue on Physics and chemistry of water and ice has now been published online – take a look today!

The issue was Guest Edited by Carlos Vega, Jose Luis F. Abascal and Pablo G. Debenedetti.

The Physics and chemistry of water and ice themed issue features a broad range of papers and Communications and includes the following Perspective articles:

Simulating water with rigid non-polarizable models: a general perspective
Carlos Vega and Jose L. F. Abascal
Phys. Chem. Chem. Phys., 2011, 13, 19663-19688
DOI: 10.1039/C1CP22168J

Water and aqueous solutions: simple non-speculative model approach
Ivo Nezbeda and Jan Jirsák
Phys. Chem. Chem. Phys., 2011, 13, 19689-19703
DOI: 10.1039/C1CP21903K

Take a look at the issue today!
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Multiply charged ions (MCIs) in the gas-phase themed issue out now

 We are delighted to announce that the PCCP themed issue on Multiply charged ions (MCIs) in the gas-phase has now been published online – take a look today!
 

The issue was Guest Edited by Stephen Price (University College London) and Jana Roithová (Charles University, Prague).
 
 
The
Multiply charged ions (MCIs) in the gas-phase themed issue features a broad range of papers, Perspective reviews and Communications, including the following Perspective articles:  


Multiply-charged ions and interstellar chemistry
Diethard Kurt Böhme
Phys. Chem. Chem. Phys., 2011, 13, 18253  

Doubly-charged ions in the planetary ionospheres: a review 
Roland Thissen, Olivier Witasse, Odile Dutuit, Cyril Simon Wedlund, Guillaume Gronoff and Jean Lilensten
Phys. Chem. Chem. Phys., 2011, 13, 18264


The issue has two very artistic cover images – the ‘cosmic’ front cover by Diethard Kurt Böhme and the inside front cover by Pauwels et al. that depicts the similarities between clusters and Goldilocks’ porridge!

Take a look at the issue today!

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Physics and Chemistry of Cold Molecules themed issue out now!

We are delighted to announce that the PCCP themed issue on Physics and Chemistry of Cold Molecules has now been published online – take a look today!

The issue was Guest Edited by Olivier Dulieu, Roman Krems, Matthias Weidemüller and Stefan Willitsch.

The Physics and Chemistry of Cold Molecules themed issue features a broad range of papers and includes the following Perspective article:

Deceleration of supersonic beams using inhomogeneous electric and magnetic fields
Stephen D. Hogan, Michael Motsch and Frédéric Merkt
Phys. Chem. Chem. Phys., 2011, 13, 18705

Take a look at the issue today!

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Microbial fuel cell uses urine to produce energy

Urine-powered fuel cells could generate electricity and reclaim essential nutrients directly from human and animal waste, say UK scientists. The development could make wastewater treatment easier and cheaper, and provide an abundant source of locally generated power.

The team, led by Ioannis Ieropolous and John Greenman at the Bristol Robotics Laboratory, developed microbial fuel cells (MFCs) – which use bacteria to break down organic molecules and generate electricity – that could run on the organic molecules found in urine, such as uric acid, creatinine and small peptides. 

Finding the right bacteria to munch these molecules was relatively easy – wastewater treatment plants routinely employ bacteria to do the job. But the crucial point, says Ieropoulos, is that the current processes are energy intensive, whereas the fuel cell approach could turn it into an energy-generating process. Getting the urine on the other hand, required a volunteer. ‘It’s one of us,’ quips Greenman, ‘but we’re not going to say which one.’

The bacteria form a robust biofilm on the anode surface of the fuel cell, and pass electrons to the electrode as they respire and metabolise the fuel molecules in the urine. The team have found that smaller cells have higher energy densities, ‘so we’ve followed a path of miniaturisation and multiplication, building stacks of cells,’ says Ieropoulos. An individual cell can produce a current of 0.25mA for 3 days from 25ml of urine, so stacks of hundreds or thousands of cells could run on the amounts of urine available from homes, farms, or public toilets, for example. ‘Initially we’d probably be targeting local microgeneration,’ says Greenman.

Urine fuel cell

The microbial fuel cell metabolises organic compounds in urine to produce electricity

The lack of solids – which could clog up the fuel cells – in urine compared to more general wastewater gives this system a significant advantage, comments Lars Angenent, director of the agricultural waste management lab at Cornell University in Ithaca, US. But, he points out, there are some issues: ‘Firstly, there is a societal question – do people want to separate their urine?’ Although there are modern toilets that can perform the separation, it would require a social change. ‘Then there is the cost issue – they’ve shown it can be done, but will it be economical?’

Angenent observes that some research has moved from fuel cells towards electrolysis of the urea in wastewater to form hydrogen or hydrogen peroxide. These valuable products help balance the device costs. However, as Ieropolous explains, the bacteria in their fuel cell can’t metabolise urea as fuel, so it could be possible to pass the urine first through an electrolytic cell to generate hydrogen, then through the MFC to generate electricity from the other organics.

As well as generating power, the team’s MFCs could help reclaim essential nutrients from waste, adds Greenman. Urine is particularly troublesome in wastewater treatment, since it not only contains organic compounds, but also high levels of nitrogen, phosphorus and potassium. Treatment plants currently expend significant effort and energy removing these elements from wastewater, as releasing them constitutes environmental pollution in the same way as excess fertiliser leaching from agricultural land – it promotes algal blooms that can choke out rivers and waterways.

The fuel cell bacteria could sequester those salts to grow and divide, but in normal urine the balance of nutrients is wrong – there isn’t enough carbon fuel for them to grow fast enough to take up sufficient amounts of the other elements. ‘But if you balance it by adding a cheap carbon source like acetate,’ says Greenman, ‘all the nitrogen, phosphate and potassium is captured into daughter bacteria, which perfuse out of the MFC and can be filtered out and dug back into the ground as fertiliser.’

Phillip Broadwith

Read the paper from Physical Chemistry Chemical Physics:

Urine utilisation by Microbial Fuel Cells; energy fuel for the future
Ioannis Ieropoulos, John Greenman and Chris Melhuish
Phys. Chem. Chem. Phys., 2011
DOI: 10.1039/c1cp23213d

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Turkish Chemical Society Poster Prizes

PCCP was delighted to sponsor two poster prize awards at the 9th Electrochemistry Meeting which was held in Izmir, Turkey on 25-29 Sept 2011. The Turkish Chemical Society is one of the 17 Owner Societies of PCCP.

Congratulations to Mehmet Gümüştaş and Doğukan Hazar Apaydın who were awarded the PCCP Poster Prizes!
 Ord. Prof. Dr. İlhami Cıvaoğlu Award

 

 

 

 

 

 

 

 
Ord. Prof. Dr. İlhami Cıvaoğlu Award
Electrochemical Behaviour of Epirubicin at Boron doped Diamond Electrode and its Determination in the presence of Surfactants
Sevinç Tuncagil, Mehmet Gümüştaş, Burçin Bozal, Bengi Uslu, Sibel A. Özkan
(Ankara University, Hitit University)

Prof.Dr. Ali Rıza Berkem Award

 

 

 

 

 

 

 

 

Prof.Dr. Ali Rıza Berkem Award
Azobenzene Conatining Conjugated Polymers and Their Electrochromic Applications
Doğukan Hazar Apaydın, Hava Akpınar, Merve Şendur, Levent Toppare
(Middle East Technical University, Ankara)

Poster Award Jury
Prof. Dr. Lo Gorton
Prof. Dr. Ümit Demir

PCCP will be awarding more Poster Prizes next year, so please do let us know of any suitable conferences which PCCP could sponsor in 2012.

Submit your lastest research to PCCP today!

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Top Ten most-read PCCP articles in September

This month sees the following articles in PCCP that are in the top ten most accessed in September:

A multifaceted approach to hydrogen storage 
Andrew J. Churchard, Ewa Banach, Andreas Borgschulte, Riccarda Caputo, Jian-Cheng Chen, David Clary, Karol J. Fijalkowski, Hans Geerlings, Radostina V. Genova, Wojciech Grochala, Tomasz Jaroń, Juan Carlos Juanes-Marcos, Bengt Kasemo, Geert-Jan Kroes, Ivan Ljubić, Nicola Naujoks, Jens K. Nørskov, Roar A. Olsen, Flavio Pendolino, Arndt Remhof, Loránd Románszki, Adem Tekin, Tejs Vegge, Michael Zäch and Andreas Züttel 
Phys. Chem. Chem. Phys., 2011, 13, 16955-16972 
DOI: 10.1039/c1cp22312g 

Graphene and carbon nanotube composite electrodes for supercapacitors with ultra-high energy density 
Qian Cheng, Jie Tang, Jun Ma, Han Zhang, Norio Shinya and Lu-Chang Qin 
Phys. Chem. Chem. Phys., 2011, 13, 17615-17624 
DOI: 10.1039/c1cp21910c 

Graphene-based electrochemical energy conversion and storage: fuel cells, supercapacitors and lithium ion batteries 
Junbo Hou, Yuyan Shao, Michael W. Ellis, Robert B. Moore and Baolian Yi 
Phys. Chem. Chem. Phys., 2011, 13, 15384-15402 
DOI: 10.1039/c1cp21915d 

Excited-state calculations with TD-DFT: from benchmarks to simulations in complex environments 
Denis Jacquemin, Benedetta Mennucci and Carlo Adamo 
Phys. Chem. Chem. Phys., 2011, 13, 16987-16998 
DOI: 10.1039/c1cp22144b 

Graphene-encapsulated iron microspheres on the graphene nanosheets 
Peng Guo, Guang Zhu, Huaihe Song, Xiaohong Chen and Shijun Zhang 
Phys. Chem. Chem. Phys., 2011, 13, 17818-17824 
DOI: 10.1039/c1cp22378j 

Density functional theory for transition metals and transition metal chemistry 
Christopher J. Cramer and Donald G. Truhlar 
Phys. Chem. Chem. Phys., 2009, 11, 10757-10816 
DOI: 10.1039/b907148b 

Simulating water with rigid non-polarizable models: a general perspective 
Carlos Vega and Jose L. F. Abascal 
Phys. Chem. Chem. Phys., 2011, Advance Article 
DOI: 10.1039/c1cp22168j 

Second-order optical nonlinearity and ionic conductivity of nanocrystalline GeS2–Ga2S3–LiI glass-ceramics with improved thermo-mechanical properties 
Changgui Lin, Laurent Calvez, Bruno Bureau, Haizheng Tao, Mathieu Allix, Zhangxiang Hao, Vincent Seznec, Xianghua Zhang and Xiujian Zhao 
Phys. Chem. Chem. Phys., 2010, 12, 3780-3787 
DOI: 10.1039/b921909a 

Carbon materials for supercapacitor application 
Elzbieta Frackowiak 
Phys. Chem. Chem. Phys., 2007, 9, 1774-1785 
DOI: 10.1039/b618139m 

Theoretical studies of 31P NMR spectral properties of phosphanes and related compounds in solution 
Boris Maryasin and Hendrik Zipse
Phys. Chem. Chem. Phys., 2011, 13, 5150-5158 
DOI: 10.1039/c0cp02653k 

Why not take a look at the articles today and blog your thoughts and comments below.

Fancy submitting an article to PCCP? Then why not submit to us today or alternatively email us your suggestions.

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Top Ten most-read PCCP articles in August

This month sees the following articles in PCCP that are in the top ten most accessed in August:

Graphene-based electrochemical energy conversion and storage: fuel cells, supercapacitors and lithium ion batteries
Junbo Hou, Yuyan Shao, Michael W. Ellis, Robert B. Moore and Baolian Yi 
Phys. Chem. Chem. Phys., 2011, 13, 15384-15402 
DOI: 10.1039/c1cp21915d 

Density functional theory for transition metals and transition metal chemistry 
Christopher J. Cramer and Donald G. Truhlar 
Phys. Chem. Chem. Phys., 2009, 11, 10757-10816 
DOI: 10.1039/b907148b 

Characterization of nanostructured hybrid and organic solar cells by impedance spectroscopy 
Francisco Fabregat-Santiago, Germà Garcia-Belmonte, Iván Mora-Seró and Juan Bisquert 
Phys. Chem. Chem. Phys., 2011, 13, 9083-9118 
DOI: 10.1039/c0cp02249g 

Titania supported gold nanoparticles as photocatalyst 
Ana Primo, Avelino Corma and Hermenegildo García 
Phys. Chem. Chem. Phys., 2011, 13, 886-910
DOI: 10.1039/c0cp00917b 

Colloidal metal nanoparticles as a component of designed catalyst 
Chun-Jiang Jia and Ferdi Schüth 
Phys. Chem. Chem. Phys., 2011, 13, 2457-2487 
DOI: 10.1039/c0cp02680h 

Carbon materials for supercapacitor application
Elzbieta Frackowiak 
Phys. Chem. Chem. Phys., 2007, 9, 1774-1785 
DOI: 10.1039/b618139m 

CVD graphene electrochemistry: the role of graphitic islands 
Dale A. C. Brownson and Craig E. Banks 
Phys. Chem. Chem. Phys., 2011, 13, 15825-15828 
DOI: 10.1039/c1cp21978b 

Recent progress in SERS biosensing 
Kyle C. Bantz, Audrey F. Meyer, Nathan J. Wittenberg, Hyungsoon Im, Özge Kurtuluş, Si Hoon Lee, Nathan C. Lindquist, Sang-Hyun Oh and Christy L. Haynes 
Phys. Chem. Chem. Phys., 2011, 13, 11551-11567 
DOI: 10.1039/c0cp01841d 

Electrocatalysis of oxygen reduction and small alcohol oxidation in alkaline media 
Jacob S. Spendelow and Andrzej Wieckowski 
Phys. Chem. Chem. Phys., 2007, 9, 2654-2675 
DOI: 10.1039/b703315j 

A thorough benchmark of density functional methods for general main group thermochemistry, kinetics, and noncovalent interactions 
Lars Goerigk and Stefan Grimme 
Phys. Chem. Chem. Phys., 2011, 13, 6670-6688 
DOI: 10.1039/c0cp02984j 

Why not take a look at the articles today and blog your thoughts and comments below.

Fancy submitting an article to PCCP? Then why not submit to us today or alternatively email us your suggestions.

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Top Ten most-read PCCP articles in July

This month sees the following articles in PCCP that are in the top ten most accessed:-

Weak hydrogen bonds – strong effects? 
W. A. Herrebout and M. A. Suhm 
Phys. Chem. Chem. Phys., 2011, 13, 13858-13859 
DOI: 10.1039/C1CP90110A  

Multiple exciton generation in nanocrystal quantum dots – controversy, current status and future prospects 
David J. Binks 
Phys. Chem. Chem. Phys., 2011, 13, 12693-12704
DOI: 10.1039/C1CP20225A  

Titania supported gold nanoparticles as photocatalyst 
Ana Primo, Avelino Corma and Hermenegildo García 
Phys. Chem. Chem. Phys., 2011, 13, 886-910
DOI: 10.1039/C0CP00917B  

Hofmeister effects: interplay of hydration, nonelectrostatic potentials, and ion size 
Drew F. Parsons, Mathias Boström, Pierandrea Lo Nostro and Barry W. Ninham 
Phys. Chem. Chem. Phys., 2011, 13, 12352-12367 
DOI: 10.1039/C1CP20538B 

Photoselective excited state dynamics in ZnO?Au nanocomposites and their implications in photocatalysis and dye-sensitized solar cells  
Soumik Sarkar, Abhinandan Makhal, Tanujjal Bora, Sunandan Baruah, Joydeep Dutta and Samir Kumar Pal
Phys. Chem. Chem. Phys., 2011, 13, 12488-12496 
DOI: 10.1039/C1CP20892F 

Recent progress in SERS biosensing
Kyle C. Bantz, Audrey F. Meyer, Nathan J. Wittenberg, Hyungsoon Im, Özge Kurtuluş, Si Hoon Lee, Nathan C. Lindquist, Sang-Hyun Oh and Christy L. Haynes 
Phys. Chem. Chem. Phys., 2011, 13, 11551-11567 
DOI: 10.1039/C0CP01841D  

Colloidal metal nanoparticles as a component of designed catalyst
Chun-Jiang Jia and Ferdi Schüth 
Phys. Chem. Chem. Phys., 2011, 13, 2457-2487 
DOI: 10.1039/C0CP02680H  

Density functional theory for transition metals and transition metal chemistry 
Christopher J. Cramer and Donald G. Truhlar 
Phys. Chem. Chem. Phys., 2009, 11, 10757-10816 
DOI: 10.1039/B907148B  

High performance supercapacitors based on highly conductive nitrogen-doped graphene sheets 
Yongcai Qiu, Xinfeng Zhang and Shihe Yang 
Phys. Chem. Chem. Phys., 2011, 13, 12554-12558 
DOI: 10.1039/C1CP21148J  

Characterization of nanostructured hybrid and organic solar cells by impedance spectroscopy 
Francisco Fabregat-Santiago, Germà Garcia-Belmonte, Iván Mora-Seró and Juan Bisquert 
Phys. Chem. Chem. Phys., 2011, 13, 9083-9118 
DOI: 10.1039/C0CP02249G

Why not take a look at the articles today and blog your thoughts and comments below.

Fancy submitting an article to PCCP? Then why not submit to us today or alternatively email us your suggestions.

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