Single and multi-step phase transformation in CuZr nanowire under compressive/tensile loading

A novel stress induced martenistic phase transformation is reported in an initial B2-CuZr nanowire of cross-sectional dimensions in the range of 19.44 x 19.44-38.88 x 38.88 angstrom(2) and temperature in the range of 10-400 K under both tensile and compressive loading. Extensive Molecular Dynamic simulations are performed using an inter-atomic potential of type Finnis and Sinclair. The nanowire shows a phase transformation from an initial B2 phase to BCT (body-centered-tetragonal) phase with failure strain of similar to 40% in tension, whereas in compression, comparatively a small B2 -> BCT phase transformation is observed with failure strain of similar to 25%. Size and temperature dependent deformation mechanisms which control ultimately the B2 -> BCT phase transformation are found to be completely different for tensile and compressive loadings. Under tensile loading, small cross-sectional nanowire shows a single step phase transformation, i.e. B2 -> BCT via twinning along {100} plane, whereas nanowires with larger cross-sectional area show a two step phase transformation, i.e. B2 -> R phase -> BCT along with intermediate hardening. In the first step, nanowire shows phase transformation from B2 -> R phase via twinning along {100} plane, afterwards the nanowire deforms via twinning along {110} plane which cause further transformation from R phase -> BCT phase. Under compressive loading, the nanowire shows crushing along {100} plane after a single step phase transformation from B2 -> BCT. Proper tailoring of such size and temperature dependent phase transformation can be useful in designing nanowire for high strength applications with corrosion and fatigue resistance. (C) 2009 Elsevier Ltd. All rights reserved.

Formation ranges of icosahedral, amorphous and crystalline phases in rapidly solidified Ti-Zr-Hf-Ni alloys

From the quaternary Ti-Zr-Hf-Ni phase diagram. the cross-section at 20 at % Ni was selected for investigation. The icosahedral quasicrystalline, crystalline and amorphous phases were observed to form in nine kinds of rapidly solidified (TixZryHfz)(80)Ni-20 (x + y + z = 1) alloys at different compositions. The quasilattice constants of 0.519 and 0.531 nm were obtained for the icosahedral phase formed in the melt-spun Ti40Zr20Hf20Ni20 and Ti20Zr40Hf20Ni20 alloys. respectively. The icosahedral phase formed in the melt-spun Ti40Zr20Hf20Ni20 alloy especially is thermodynamically stable. The supercooled liquid region of the Ti20Zr20Hf40Ni20 glassy alloy reached 64 K. From these results a comparison of quasicrystal-forming and glass-forming abilities, was carried out. The quasicrystal-forming ability was reduced and glass-forming ability was improved with an increase in Hf and Zr contents in the (TixZryHfz)(80)Ni-20 alloys. On the other hand. an increase in Ti content caused an improvement in quasicrystal-forming ability.

"Ni sit mä tajusin, et on muitakin kuin minä" : Suomenuskoisten sosiaalinen identiteetti

Työ on uskontososiologian tutkimusalaan lukeutuva laadullinen tapaustutkimus, joka perustuu argumentatiiviseen haastatteluaineistoon ja sosiaalisen identiteetin teoriaan. Tutkimuskysymys liittyy sosiaalisen identiteettiin. Miten suomenuskoinen hahmottaa oman yhteisönsä ja sen jäsenyyden? Mitä merkitystä yhteisöllä on suomenuskoiselle? Tutkimuksen aihepiiri on suomalainen uuspakanuus ja sen eräs suuntaus, suomenusko. Työn eräänä tarkoituksena on määritellä suomenuskon käsitettä ja sijoittaa suomenuskoinen suuntaus nykyajan suomalaisen uuspakanuuden kentälle. Hypoteesin mukaan suomenusko on uusiin uskontoihin lukeutuva uuspakanallinen liike. Se kuuluu ásatrún tavoin etnopakanuuden luokkaan, eli kansallisista muinaisperinteistä inspiraationsa ammentaviin suuntauksiin. Suomenuskolle on omalaatuista esikristillisten suomalaisten uskontoperinteiden sekä suomalaisen kansanuskon korostaminen lähteinä. Suomenuskon muut ominaispiirteet vastaavat tyypillistä uuspakanuutta: Luonnon ja perinteiden kunnioitus sekä epädogmaattisuus ja tasavertaisuus ovat keskeisiä arvoja. Työ tehtiin puolistrukturoituna haastattelututkimuksena. Seitsemää suomenuskoista haastateltiin laadullisen asennetutkimuksen menetelmän mukaisesti. Menetelmä on uudehko ja kiinnostava. Se perustuu argumentatiivisen haastatteluaineiston tuottamiseen väittämäkorttien avulla. Analyysissä haastatteluaineistosta paikannetaan asenteita, eli subjektin ilmaisemaa jonkin kohteen arvottamista. Asenteista pyrittiin löytämään ulkoryhmiin kohdistuvia vertailuja ja retorisia erottautumisia. Työn teoreettisena tukirankana on Henri Tajfelin ja John C. Turnerin kehittämä sosiaalisen identiteetin teoria. Teorian mukaan sosiaalista identiteettiä on mahdollista tutkia ainoastaan sosiaalisten ryhmien keskinäisen vertailun asetelmassa. Omia sisäryhmiä vertaillaan aina ulkoryhmiin siten, että oma ryhmä näyttäytyy voittajana. Tämä takaa yksilölle myönteisen omanarvontunnon. Karmela Liebkindin mukaan vähemmistöryhmät vertailevat itseään valtakulttuurin enemmistöryhmiin. Heikki Pesosen ja Elina Huhdan mukaan vähemmistöuskonnot pyrkivät oikeuttamaan omaa uskontoaan tekemällä omalle ryhmälle suotuisia vertailuja. Tutkimuksessa havaittiin haastateltavien tekemiä retorisia erottautumisia ulkoryhmistä sekä heidän ilmaisemiaan asenteita, jotka liittyvät suomenuskoisten sisäryhmän dynamiikkaan. Tulosten perusteella haastatellut suomenuskoiset erottautuvat ryhmänä muusta uuspakanuudesta ja vielä selvemmin New Agesta ja satanismista, jotka eivät ole uuspakanuutta. Lisäksi haastateltavat korostavat eroa dogmaattisiin valtauskontoihin, varsinkin evankelis-luterilaisen valtionkirkon enemmistöryhmään. Suomenuskoisten yhteisöön liittymisen prosessin havaittiin muistuttavan sosiaalista itsekategorisointia yhteisön jäsenyydessä ratkaiseva tekijä on oman jäsenyyden tajuaminen itse. Teorian mukaan tämä johtaa sosiaalisen identiteetin muodostumiseen ja siten ryhmäkäyttäytymiseen. Haastateltavilla oli havaittavissa vahva sosiaalinen identiteetti. Uuspakanuuden kenttään suhteutettuna se oli poikkeuksellisen yhtenäinen. Lisäksi selvisi, että suomenuskoiset suunnittelevat uskonnolliseksi yhdyskunnaksi rekisteröitymistä.

Asymmetry in structural and thermo-mechanical behavior of intermetallic NiAl nanowire under tensile/compressive loading: A molecular dynamics study

The asymmetric stress strain behavior under tension/compression in an initial < 100 > B-2-NiAl nanowire is investigated considering two different surface configurations i.e., < 100 >/(0 1 0) (0 0 1) and < 100 >/(0 1 1) (0 - 1 1). This behavior is attributed to two different deformation mechanisms namely a slip dominated deformation under compression and a known twinning dominated deformation under tension. It is also shown that B2 -> BCT (body-centered-tetragonal) phase transformation under tensile loading is independent of the surface configurations for an initial < 100 > oriented NiAl nanowire. Under tensile loading, the nanowire undergoes a stress-induced martensiticphase transformation from an initial B2 phase to BCT phase via twinning along {110} plane with failure strain of similar to 0.30. On the other hand, a compressive loading causes failure of these nanowires via brittle fracture after compressive yielding, with a maximum failure strain of similar to-0.12. Such brittle fracture under compressive loading occurs via slip along {110} plane without any phase transformations. Softening/hardening behavior is also reported for the first time in these nanowires under tensile/compressive loadings, which cause asymmetry in their yield strength behavior in the stress strain space. Result shows that a sharp increase in energy with increasing strain under compressive loading causes hardening of the nanowire, and hence, gives improved yield strength as compared to tensile loading. (C) 2010 Elsevier Ltd. All rights reserved.

Competing magnetic interactions in a dinuclear Ni(II) complex: Antiferromagnetic O-H center dot center dot center dot O moiety and ferromagnetic N-3(-) ligand

Synthesis, structural characteristics, magnetic studies and DFT calculations in Ni(II) dinuclear complexes containing two bridging N-3(-) and an O-(HO)-O-... linkage reveal the existence of ferromagnetic interactions between Ni(II) centers via N-3(-) ligands and antiferromagnetic interactions through the H-bonded moiety. The overall magnetic behavior of the system depends on the delicate balance between these two competing interactions.

Characterization of Alloy-Spinel-Corundum Equilibrium in the System Fe-Ni-Al-O

The three phase equilibrium between alloy, spinel solid solution and α-alumina in the Fe-Ni-Al-O system has been fully characterized at 1823K as a function of alloy composition using both experimental and computational methods. The oxygen potential was measured using a solid state cell incorporating yttria-doped thoria as the electrolyte and Cr+ Cr2O3 as the reference electrode. Oxygen concentration of the alloy was determined by an inert gas fusion technique. The composition of the spinel solid solution, formed at the interface between the alloy and an alumina crucible, was determined by EPMA. The variation of the oxygen concentration and potential and composition of the spinel solid solution with mole fraction of nickel in the alloy have been computed using activities in binary Fe-Ni system, free energies of formation of end member spinels FeO•(1+x)Al2O3 and NiO•(1+x)Al2O3 and free energies of solution of oxygen in liquid iron and nickel, available in the literature. Activities in the spinel solid solution were computed using a cation distribution model. The variation of the activity coefficient of oxygen with alloy composition in Fe-Ni-O system was calculated using both the quasichemical model of Jacob and Alcock and the Wagner's model, with the correlation of Chiang and Chang. The computed results for the oxygen potential and the composition of the spinel solid solution are in good agreement with the measurements. The measured oxygen concentration lies between the values computed using models of Wagner and Jacob and Alcock. The results of the study indicate that the deoxidation hyper-surface in multicomponent systems can be computed with useful accuracy using data for end member systems and thermodynamic models.

An in situ EXAFS investigation of bimetallic Cu---Ni/γ-Al2O3 catalysts

In situ EXAFS investigations have been carried out on Ni/γ-Al2O3 and Cu---Ni/γ-Al2O3 catalysts with different metal loadings, and prepared by different procedures. As-prepared Ni/γ-Al2O3 on calcination gives NiO and NiAl2O4-like phases on the surface, the proportion of the latter increasing with the increase in calcination temperature; the proportion of the NiO-like phase, on the other hand, increases with the metal loading. The reducibility of Ni/γ-Al2O3 to give metallic Ni on the surface directly depends on the proportion of the NiO-like phase present before reduction. Co-impregnating with Cu suppresses the formation of the surface aluminate and thereby favours the reduction to metallic Ni. This conclusion is clearly substantiated by our studies of bimetallic catalysts containing varying Cu/Ni ratios and also those prepared by the two-stage impregnation procedure.

Effects of Parasitics and Interface Traps on Ballistic Nanowire FET in the Ultimate Quantum Capacitance Limit

In this paper, we focus on the performance of a nanowire field-effect transistor in the ultimate quantum capacitance limit (UQCL) (where only one subband is occupied) in the presence of interface traps (D-it), parasitic capacitance (C-L), and source/drain series resistance (R-s,R-d), using a ballistic transport model and compare the performance with its classical capacitance limit (CCL) counterpart. We discuss four different aspects relevant to the present scenario, namely: 1) gate capacitance; 2) drain-current saturation; 3) subthreshold slope; and 4) scaling performance. To gain physical insights into these effects, we also develop a set of semianalytical equations. The key observations are as follows: 1) A strongly energy-quantized nanowire shows nonmonotonic multiple-peak C-V characteristics due to discrete contributions from individual subbands; 2) the ballistic drain current saturates better in the UQCL than in the CCL, both in the presence and absence of D-it and R-s,R-d; 3) the subthreshold slope does not suffer any relative degradation in the UQCL compared to the CCL, even with Dit and R-s,R-d; 4) the UQCL scaling outperforms the CCL in the ideal condition; and 5) the UQCL scaling is more immune to R-s,R-d, but the presence of D-it and C-L significantly degrades the scaling advantages in the UQCL.

Preparation, characterization, spectral and thermal analyses of (N2H5)2MCl4·2H2O (M = Fe, Co, Ni and Cu); crystal structure of the iron complex

Hydrazinium metal chlorides, (N2H5)2MCl4·2H2O (where M = Fe, Co, Ni and Cu), have been prepared from the aqueous solutions of the respective metal chlorides and hydrazine hydrochloride (N2H4·HCl or N2H4·2HCl) and investigated by spectral and thermal analyses. The crystal structure of the iron complex has been determined by direct methods and refined by full-matrix least-squares to an R of 0.023 and Rw of 0.031 for 1495 independent reflections. The structure shows ferrous ion in an octahedral environment bonded by two hydrazinium cations, two chloride anions and two water molecules. In the complex cation [Fe(N2H5)2(H2O)2Cl2]2+, the coordinated groups are in trans positions.