Some Current Research Projects of the Kramer Group


Fundamentals of Block Copolymer Directed Assembly

Our aim is to discover both new directed assembly methods and their limitations for achieving good translational and orientational order in 2D arrays of block copolymer domains, methods that could ultimately lead to nanopatterns that could be transferred to underlying substrates. We investigate directed self-assembly techniques whereby the edges of regions defined by optical and electron beam lithography serve to register and template the order. Emphasis is placed on understanding the ordering and disordering processes in melts of both single layer and multilayer films of spherical domain block copolymers and their blends with homopolymers in such regions. State-of-the art scanning force microscopy (SFM or AFM) and grazing incidence small angle X-ray scattering (GISAXS) at the Advanced Photon Source Beamline 8_ID-E XOR are used in a complementary fashion to precisely define the order in these layers. Directed self-assembly is also of interest for cylindrical domain block copolymer films with cylinders parallel to the film surface. Here controlling the equilibrium concentration of dislocations and the thermal unbinding of their component disclinations using nearby channel edges is the primary challenge. These experiments also exploit the depth profiling capabilities of dynamic secondary ion mass spectrometry (SIMS) ,to provide depth information, transmission electron microscopy, low voltage scanning electron microscopy and scanning force microscopy to provide imaging of lateral and cross-sectional film phase structures. Our experiments will be supplemented with field theoretic numerical simulations of 2D block copolymer ordering in collaboration with Glenn Fredrickson at UCSB. The results from this project have the potential to impact a range of new processing technologies, such as new lithographic techniques, new ways to produce selective membranes and new ways to form thin film optical or magnetic elements.
Highlights of recent research 2002
Highlights of recent research 2003
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Highlights of recent research 2007

Soft Cellular Materials

The UCSB MRL's Interdisciplinary Research Group project in this area aims to use tailored nanoparticles and nanostructured polymers to stabilize unique and potentially useful structures in multiphase polymer materials such as bi-continuous block copolymer films, high internal phase polymer emulsions and polymer foams. Interfacially active nanoparticles in block copolymers and homopolymer mixtures may be useful as a new class of surfactants which impart functionality and can lead to new morphologies. We have discovered that Au nanoparticles coated with the appropriate mixture of short A and B chains reside at the interfaces between domains in an A-B diblock copolymer. Remarkably mixtures of A and B ligands on such nanoparticles ranging from 90%A to 10% A all result in mixed surface nanoparticles being attracted to A-B interfaces. These results suggest that the A and B end-functional thiol ligands on these Au nanoparticles are mobile on the nanoparticle surface and can form “Janus” particles in contact with the A-B interface, particles that will bind much more strongly than particles coated randomly with A and B ligands. We have developed an even more simple strategy for controlling the location of gold nanoparticles within block copolymer domains through varying the surface coverage of gold nanoparticles by end-attached polymer ligands. Gold nanoparticles coated by short thiol end functional polystyrene homopolymers (PS-SH) (Mn=3.4 kg/mol) are incorporated into a poly(styrene-b-2-vinylpyridine) diblock copolymer template (PS-b-P2VP) (Mn=196 kg/mol), the P2VP block of which has a more favorable interaction with a bare gold particle surface than does the PS block. The areal density of PS chains on the gold particles is found to be critical to controlling their location in block copolymer templates, below a critical value the gold particles go to the interface. The adsorption energy of nanoparticle segregation to the interface can thus be tuned by changing the composition of the polymer ligands on the nanoparticle and by decreasing the areal chain density of these ligands. We are developing more controlled inorganic nanoparticle synthesis methods in order to produce more nearly monodisperse size polymer-coated nanoparticles and with these methods in hand, we will systematically explore the effects of nanoparticle size on A-B diblock copolymer morphology where the nanoparticles segregate to the interface.

Ambiguous Surfaces for Biofouling Resistant, High Fouling Release Coatings

Our main objective in this project, which is carried out in collaboration with Prof. Chris Ober at Cornell, is to to develop new non-toxic, fouling resistant coatings using the principle of controlled energy surfaces. The project builds on our current research and involves the formation of fouling resistant coatings from specifically synthesized surface-active block copolymers (SABC) that form tough coatings with surfaces of selected polarity and structure used in combination with commercially available, styrene-ethylene/butylene-styrene (SEBS) thermoplastic elastomers. As a result of recent successful studies we are focussing on the preparation and testing of tailored and well characterized “ambiguous surfaces” with either amphiphilic and/or mixed surface structure in which chemical function is selected to hinder settlement of marine biofouling organisms and improve ease of removal of such organisms, a property known as fouling release. The advantage of this approach is that we can create a low cost coating with molecular level control of the fouling resistant (FR) surface to replace coatings that depend on leaching toxic metals into the marine environment. Such coatings are likely to be banned in the near future from partially enclosed waterways, such as harbors, where such metals can build up to levels that threaten all aquatic life. The goal of this research is thus to produce FR coatings and to understand the fundamental nature of the surface required for fouling release. The coatings will be tested for their ability to provide specific surface properties. Surface analytical methods will include X-ray photoelectron spectroscopy (XPS), near-edge X-ray absorption fine structure (NEXAFS), and scanning force microscopy (SFM) as well as contact angle studies. In addition, studies of fouling release in conjunction with investigators such as M. Callow, D. Wendt and M. Hadfield will also provide direct evaluation of the performance of these surfaces in marine fouling environments. Such measurements are essential in providing feedback to allow us to discern the connections between the molecular and higher level structures of our surfaces and their fouling resistance/release.
Highlights of recent research

Block Copolymers and Networks with Thermally Reversible Hydrogen Bonding

The aim of this project, which is a collaboration with Craig Hawker's and Glenn Fredrickson's groups, with great help on the synthesis side from Bert Meijer's group at the Technical University of Eindhoven, NL, is to gain an understanding of how thermally reversible bonds affect the physical properties and assembly behavior of synthetic polymer materials. The collaboration has developed the synthetic tools to make well-defined (i.e. low polydispersity) polymers containing a multiple hydrogen bonding (MHB) functionality at one chain end and are extending these techniques to telechelic polymers and random copolymers with MHB groups in the side chain. Our focus is on two MHB dimers in particular—UPy-UPy (self complementary), and UPy-Napy (heterocomplementary) to study the effects of directionality of the hydrogen bonding group. Homopolymers functionalized with either UPy or Napy at one end of the chain are blended together in the bulk to form “supramolecular diblock copolymers,” which are expected to behave like covalent diblocks in the extreme of high binding strength (low temperature) and homopolymer blends in the extreme of low binding strength (high temperature).

Multiblock Polyolefin Copolymers with Semicrystalline and Rubbery Blocks

Conventional thermoplastic elastomers are based on amorphous triblock copolymers that have glassy end blocks and rubbery mid-blocks, e.g. SBS, SIS and SEBS. The elastomeric properties of these depend on achieving a microphase-separated structure and the glassy end blocks must be sufficiently long so that their Tg is well above room temperature and so that these blocks are sufficiently well anchored. If the blocks are long however the order-disorder temperature will be high and the block copolymers may be difficult to process at low enough temperatures such that degradation does not occur. This is a particular issue with SEBS, a block copolymer with a saturated hydrocarbon mid-block and as a result a rather large Flory-Huggins interaction parameter. Block copolymers with semi-crystalline blocks can offer potentially attractive alternatives to SEBS and other amorphous-amorphous block copolymers if the semicrystalline blocks can serve as sufficiently strong “anchors” for the rubbery midblocks allowing large strains to be achieved at low stresses while allowing the strain to be nearly completely recovered when the stress is removed. While thermoplastic elastomers from multiblock copolymers with semi-crystalline blocks are well known (spandex fibers from segmented polyurethanes are important examples and their excellent properties provide an “existence proof” of what is possible), these require rather expensive monomers. Polyolefin-based semi-crystalline thermoplastic elastomers, especially those based on polypropylene, offer attractive alternatives but until very recently were not able to be synthesized. With the development of new single site catalysts, by the groups of our collaborators Geoff Coates, Cornell and Gui Bazan, UCSB, that can carry out “living” polymerizations of ethylene and propylene and produce stereo-regular blocks of the latter, this situation have changed. In this project we investigate the relationships between the chain architecture, the microstucture and the mechanical properties of this interesting new class of block copolymer materials.

Selected Recently Completed Projects


Polymer Interfaces for Electronic Packaging

Direct chip attach microelectronic assemblies undergo hydro-thermal fatigue during field operation and reliability testing. Delamination of the underfill/passivation interface due to hydro-thermal fatigue is the cause for majority of the failures during reliability testing of these assemblies and is currently a major concern in such assemblies. Hence, it is essential to characterize the hydro-thermal fatigue resistance of the interface and to understand the mechanisms operating to cause the failure of this interface under hydrothermal fatigue. Our goals in this project are to develop methods to measure the fracture toughness, hydro-thermal fatigue crack growth resistance, hydrolysis and moisture concentration profiles at the interface between the underfill and the polyimide passivation of DCA microelectronic assemblies. We plan to use these methods to guide materials and process modification aimed at strengthening these interfaces and minimizing water absorption and attack. A major effort will be made to develop methods to characterize the hydrolysis depth profiles of the epoxy since our initial results suggest that it is very prone to network damage near the interface by water attack. Both dynamic SIMS and RBS will be used as new analytical tools for this effort as well as FTIR for analyses of bulk samples.
Highlights of recent research

Block Copolymer Diffusion

Diffusion of block copolymers is interesting to us for several reasons: Potentially, diffusion of block copolymers is exquisitively sensitive to the thermodynamic factors driving the self-assembly of the microdomain structure. The slow kinetics of segregation of block copolymers to interfaces between molten homopolymers may be one of the important limitations for using such preformed block copolymers as so-called compatibilizers for two phase polymer mixtures. In turn, these kinetics almost surely depend on either the diffusion on individual block copolymer chains, or block copolymer micelles, in one or both of the homopolymers. The chain topology of the block copolymer can be very important - we expect that A-B-A triblock copolymer will diffuse very differently from A-B diblock copolymers. Finally the time required to achieve the equilibrium ordered structure of the block copolymer will depend on the individual block copolymer chains. Our experiments use polystyrene-b-poly(2vinylpyridine) (PS-PVP) diblock copolymers and poly(2vinylpyridine)-b-polystyrene-b-poly(2vinylpyridine) (PVP-PS-PVP) triblock copolymers that we synthesize using anionic polymerization methods. Even though this system is strongly ordered, PS and PVP have almost the same glass transition temperature and monomer friction coefficient. In addition we can synthesize the matching block copolymers (dPS-PVP and PVP-dPS-PVP) with deuterium replacing hydrogen on the PS block. By measuring, using either SIMS or FRES , the depth profile of deuterium , after diffusion of a thin initial layer placed on the surface of an underlying unlabeled polymer (homopolymer, block copolymer or a mixture of the two), we can determine the diffusion coefficient. Prof. Fredrickson has been a leader in developing both theory and simulation of block copolymer diffusion and we are actively collaborating with him in devising suitable tests for the theory.
Highlights of recent research

Reactions of Polymer Chains at Polymer Interfaces

Reactions of polymer chains at interfaces between two molten polymer phases are important as a way to form graft or block copolymer interfacial compatibilizers in two phase polymer blends. The compatibilizers act as interfacial strengthening agents, as inhibiters of droplet coalescence and as polymeric surfactants. Our experimental research seeks to uncover the links between polymer interface thermodynamics, polymer reaction rates at these interfaces and the interface instabilities that develop when the interfacial tension of the flat interface is driven negative as more polymer compatibilizer molecules are created. Issues of special interest are the dependence of the rate of the grafting reaction on the length of the grafting polymer chains, how the build-up of grafted chains affects the rate of reaction leading to further formation of grafted chains and, for chains with reactive end groups, how the chemical architecture of the end affects its reactivity. To investigate these questions quantitatively we carry out these reactions at initially flat interfaces between two molten polymer thin films in which one of the components is labelled with deuterium. The areal chain density of the grafted chains at the interface is determined by depth profiling the the deuterium in the films after the reaction has proceeded for a certain time using either secondary ion mass spectrometry (SIMS) or forward recoil spectrometry (FRES) . Where the bottom film is a glassy polymer, we can wash away the top film with a non-solvent for the bottom polymer and investigate the morphology of the now-frozen interface using scanning force microscopy. In this way we are able to observe the response of the interface as the interfacial tension is driven to zero and even (transiently) negative. We also are using our methods as part of a collaborative project with Prof. Leal, Prof. Pine and Prof. Fredrickson that is aimed at understanding the fundamentals and rheology of drop break-up and coalescence under conditions where compatibilizers have been formed at the drop interface by reaction of chains with reactive end groups.
Highlights of recent research

Lateral Patterning of Domains in Block Copolymer Films

Here we are interested in producing patterns of ordered block copolymer, not only in the thickness direction of polymer films but also in the plane of the film. Such films would have uses in nanometer scale lithography, for optical devices and as substrates for biomedical manipulation of biomacromolecules and cells. To accomplish these aims we are interested in developing substrates that can be patterned so that a given area of a substrate attracts the A-block of an A-B block copolymer, attracts the B-block of the copolymer or is neutral, i.e. attracts without preference either block. Microcontact printing of self-assembled monolayers is one useful such method, using either alkane thiols or alkylsilanes to form the monolayers, but the thermal stability of such monolayers often leaves something to be desired. Surface relief structures, such as mesas and wells, are also useful in templating block copolymer order even if all surfaces attract the same block. Another goal is to develop a fundamental understanding of the kinetic processes by which such block copolymer films order. To achieve this we need to develop methods to determine the structure of these films starting from when they are deposited by spin casting from solution. A third objective is to understand the effect of confining the block copolymer during the ordering step. Thin block copolymer films often form "islands" and "holes" on the surface layer if they are annealed without confinement (i.e. with a free surface). These allow the block copolymer to adopt its optimum chain conformation locally and still present the "right" block to the surface or substrate. Confinement of the film by a stiff layer can require the chains to stretch for certain alignments of block copolymer domains and hence can favor other alignments. To achieve these goals we use forward recoil spectrometry (FRES or TOF-FRES) or dynamic secondary ion mass spectrometry (SIMS) to determine the concentration of the various blocks through the thickness of the film. The topology of film surfaces (e.g. the island or hole structure) can be easily determined by Nomarski interference optical microscopy or by scanning force microscopy (SFM). Transmission electron microscopy (TEM) to give both plan and crossectional views of the film can also provide very useful information, especially when the interface is close to being neutral for the two blocks. Over the past few years we have developed techniques for removing block copolymer films from Au layers on silicon and cross-sectioning them by ultramicrotomy. The combination of reactive ion etching and low voltage scanning electron microscopy (LV-SEM) has also proved useful in revealing the exact 3-D microstructure of block copolymer films and provides an excellent complement to TEM imaging of these films. All these techniques are available to us at UCSB for structure determination and are used as appropriate. These methods of determining the ordered structure of block copolymer films also provide needed information for our block copolymer diffusion studies while the block copolymer diffusion information helps us in our investigation of block copolymer ordering kinetics.
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Fracture of Semicrystalline Polymer Interfaces

Our major goal in this collaboration with the group of Prof. Frank Bates at the University of Minnesota is to understand how crystals in semicrystalline polymers with a rubbery amorphous phase act to anchor chains during plastic deformation and fracture. The effects of block copolymers, one block of which is semicrystalline (SC), on the fracture of interfaces between a glassy homopolymer and the semicrystalline one, can give important information about such anchoring. For example, we expect there to be a critical SC block length below which the SC block pulls out of its side of the interface. To determine this block length we will synthesize block copolymers in which the SC block is labelled with deuterium and detect the pull-out after fracture using dynamic secondary ion mass spectrometry (SIMS) and forward recoil spectrometry (FRES) to determine the deuterium content of both sides of the fracture surface. These experiments have the potential to impact our understanding not only of the fracture of interfaces between glassy and semicrystalline polymers, but also the crack growth mechanisms in important semicrystalline homopolymers such as polyethylene. Since polyethylene is being used more and more for applications (e.g., pipe for natural gas distribution) where resistance to slow crack growth is a major concern, such mechanisms are important.
Highlights of recent research

Tough Block Copolymers with Brittle Glassy Polymer Matrices

This is a collaboration with the theoretical group of Prof. Fredrickson with the polymer synthesis effort of Steve Hahn at Dow Chemical Co. aimed at understanding the fracture behavior of block copolymers consisting of blocks of brittle, glassy polymer (majority component) and blocks of ductile, semicrystalline polymer (minority component). While the physical mechanisms that control fracture and toughness of amorphous homopolymer glasses are well established, little is known about the relationships between practical toughness and chain architecture, composition, or mesoscale morphology in block copolymer materials. Working with a set of model hydrogenated block copolymer materials, we are investigating these relationships, using transmission electron microscopy, low voltage scanning electron microscopy and scanning force microscopy to provide lateral and cross-sectional views of the plastically deformed microphase separated structures in thin block copolymer films. Small angle X-ray scattering, from both samples under static strain and under rapid loading are also planned as are theoretical studies to support the experiments. These experiments have the potential to throw light on the surprising toughness of these materials.
Highlights of recent research

Structure of the Low Energy Surfaces of Semifluorinated Polymers

Our main objective in this project, which is carried out in collaboration with Prof. Chris Ober at Cornell, is to understand the role of semi-fluorinated (SF) molecules attached to the backbones of diblock copolymers in forming highly organized, stable, low-energy surfaces. To accomplish this goal, Chris Ober has developed novel synthetic routes to attach either single SF group or multiple SF groups ("monodendrons" to pendent double bonds of the polymer blocks. A palette of analytical techniques is used to characterize the structure and properties of the surfaces of thin films made of such materials. In particular, the surface morphology is investigated using scanning force microscopy (SFM). In addition, near-edge absorption fine structure (NEXAFS) experiments designed to measure the orientation of the SF groups on the surface are carried out on the Dow/NIST beamline U7A at the National Synchrotron Light Source at Brookhaven National Lab. To investigate the role of the SF groups on the stability of the thin films, both NEXAFS and SFM experiments are under way on samples annealed in-situ at elevated temperatures and samples exposed to water. The orientational changes of the SF groups and the morphology of the surfaces of thin films will be correlated with contact angle measurement and the bulk behavior of these materials as measured differential scanning calorimetry, transmission electron microscopy and X-ray diffraction.
Highlights of recent research

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