Effect of pressure on the magnetic properties of CrB₂

Magnetic susceptibility c of the itinerant antiferromagnet CrB₂ with TN ≃ 87K was studied as a function of the hydrostatic pressure up to 2 kbar at fixed temperatures 78 and 300 K. The pressure effect on c is found to be negative in sign and weakly dependent on the magnetic state of the compound. In...

Повний опис

Збережено в:
Бібліографічні деталі
Опубліковано в: :Физика низких температур
Дата:2009
Автори: Grechnev, G.E., Panfilov, A.S., Fedorchenko, A.V., Filippov, V.B., Lyashchenko, A.B., Vasiliev, A.N.
Формат: Стаття
Мова:English
Опубліковано: Фізико-технічний інститут низьких температур ім. Б.І. Вєркіна НАН України 2009
Теми:
Онлайн доступ:https://nasplib.isofts.kiev.ua/handle/123456789/117258
Теги: Додати тег
Немає тегів, Будьте першим, хто поставить тег для цього запису!
Назва журналу:Digital Library of Periodicals of National Academy of Sciences of Ukraine
Цитувати:Effect of pressure on the magnetic properties of CrB₂ / G.E. Grechnev, A.S. Panfilov, A.V. Fedorchenko, V.B. Filippov, A.B. Lyashchenko, A.N. Vasiliev // Физика низких температур. — 2009. — Т. 35, № 7. — С. 677-682. — Бібліогр.: 26 назв. — англ.

Репозитарії

Digital Library of Periodicals of National Academy of Sciences of Ukraine
id nasplib_isofts_kiev_ua-123456789-117258
record_format dspace
spelling Grechnev, G.E.
Panfilov, A.S.
Fedorchenko, A.V.
Filippov, V.B.
Lyashchenko, A.B.
Vasiliev, A.N.
2017-05-21T16:45:38Z
2017-05-21T16:45:38Z
2009
Effect of pressure on the magnetic properties of CrB₂ / G.E. Grechnev, A.S. Panfilov, A.V. Fedorchenko, V.B. Filippov, A.B. Lyashchenko, A.N. Vasiliev // Физика низких температур. — 2009. — Т. 35, № 7. — С. 677-682. — Бібліогр.: 26 назв. — англ.
0132-6414
PACS: 75.50.Ee, 75.10.Lp, 75.80.+q
https://nasplib.isofts.kiev.ua/handle/123456789/117258
Magnetic susceptibility c of the itinerant antiferromagnet CrB₂ with TN ≃ 87K was studied as a function of the hydrostatic pressure up to 2 kbar at fixed temperatures 78 and 300 K. The pressure effect on c is found to be negative in sign and weakly dependent on the magnetic state of the compound. In addition, the measured pressure dependence of the Néel temperature, dTN / dP = (0.1 ± 0.1) K/kbar, is roughly two orders of magnitude smaller than the corresponding value for the pure chromium. The main contributions to c and their volume dependence are calculated ab initio within the local spin density approximation, and appeared to be in close agreement with the experimental data.
The authors thank Prof. I.V. Svechkarev and Dr. A. Grechnev for fruitful discussions and comments. This work has been supported by the Russian–Ukrainian RFBR-NASU project 8-2009.
en
Фізико-технічний інститут низьких температур ім. Б.І. Вєркіна НАН України
Физика низких температур
Низкотемпеpатуpный магнетизм
Effect of pressure on the magnetic properties of CrB₂
Article
published earlier
institution Digital Library of Periodicals of National Academy of Sciences of Ukraine
collection DSpace DC
title Effect of pressure on the magnetic properties of CrB₂
spellingShingle Effect of pressure on the magnetic properties of CrB₂
Grechnev, G.E.
Panfilov, A.S.
Fedorchenko, A.V.
Filippov, V.B.
Lyashchenko, A.B.
Vasiliev, A.N.
Низкотемпеpатуpный магнетизм
title_short Effect of pressure on the magnetic properties of CrB₂
title_full Effect of pressure on the magnetic properties of CrB₂
title_fullStr Effect of pressure on the magnetic properties of CrB₂
title_full_unstemmed Effect of pressure on the magnetic properties of CrB₂
title_sort effect of pressure on the magnetic properties of crb₂
author Grechnev, G.E.
Panfilov, A.S.
Fedorchenko, A.V.
Filippov, V.B.
Lyashchenko, A.B.
Vasiliev, A.N.
author_facet Grechnev, G.E.
Panfilov, A.S.
Fedorchenko, A.V.
Filippov, V.B.
Lyashchenko, A.B.
Vasiliev, A.N.
topic Низкотемпеpатуpный магнетизм
topic_facet Низкотемпеpатуpный магнетизм
publishDate 2009
language English
container_title Физика низких температур
publisher Фізико-технічний інститут низьких температур ім. Б.І. Вєркіна НАН України
format Article
description Magnetic susceptibility c of the itinerant antiferromagnet CrB₂ with TN ≃ 87K was studied as a function of the hydrostatic pressure up to 2 kbar at fixed temperatures 78 and 300 K. The pressure effect on c is found to be negative in sign and weakly dependent on the magnetic state of the compound. In addition, the measured pressure dependence of the Néel temperature, dTN / dP = (0.1 ± 0.1) K/kbar, is roughly two orders of magnitude smaller than the corresponding value for the pure chromium. The main contributions to c and their volume dependence are calculated ab initio within the local spin density approximation, and appeared to be in close agreement with the experimental data.
issn 0132-6414
url https://nasplib.isofts.kiev.ua/handle/123456789/117258
citation_txt Effect of pressure on the magnetic properties of CrB₂ / G.E. Grechnev, A.S. Panfilov, A.V. Fedorchenko, V.B. Filippov, A.B. Lyashchenko, A.N. Vasiliev // Физика низких температур. — 2009. — Т. 35, № 7. — С. 677-682. — Бібліогр.: 26 назв. — англ.
work_keys_str_mv AT grechnevge effectofpressureonthemagneticpropertiesofcrb2
AT panfilovas effectofpressureonthemagneticpropertiesofcrb2
AT fedorchenkoav effectofpressureonthemagneticpropertiesofcrb2
AT filippovvb effectofpressureonthemagneticpropertiesofcrb2
AT lyashchenkoab effectofpressureonthemagneticpropertiesofcrb2
AT vasilievan effectofpressureonthemagneticpropertiesofcrb2
first_indexed 2025-11-26T01:39:29Z
last_indexed 2025-11-26T01:39:29Z
_version_ 1850603087051358208
fulltext Fizika Nizkikh Temperatur, 2009, v. 35, No. 7, p. 677–682 Effect of pressure on the magnetic properties of CrB2 G.E. Grechnev, A.S. Panfilov, and A.V. Fedorchenko B. Verkin Institute for Low Temperature Physics and Engineering of the National Academy of Sciences of Ukraine, 47 Lenin Ave., Kharkov 61103, Ukraine E-mail: panfilov@ilt.kharkov.ua V.B. Filippov and A.B. Lyashchenko I. Frantsevich Institute for Problems of Material Science, National Academy of Sciences, 3 Krzhyzhanovsky Str., Kiev 03680, Ukraine A.N. Vasiliev Department of Low Temperature Physics and Superconductivity, Physics Faculty, M.V. Lomonosov Moscow State University, Moscow 119899, Russia Received March 26, 2009 Magnetic susceptibility � of the itinerant antiferromagnet CrB2 with TN � 87 K was studied as a function of the hydrostatic pressure up to 2 kbar at fixed temperatures 78 and 300 K. The pressure effect on � is found to be negative in sign and weakly dependent on the magnetic state of the compound. In addition, the mea- sured pressure dependence of the Néel temperature, dTN /dP = (0.1 � 0.1) K/kbar, is roughly two orders of magnitude smaller than the corresponding value for the pure chromium. The main contributions to � and their volume dependence are calculated ab initio within the local spin density approximation, and appeared to be in close agreement with the experimental data. PACS: 75.50.Ee Antiferromagnetics; 75.10.Lp Band and itinerant models; 75.80.+q Magnetomechanical and magnetoelectric effects, magnetostriction. Keywords: CrB2, high pressure, magnetovolume effect, electronic structure. 1. Introduction CrB2 is an itinerant-electron antiferromagnet with the Néel temperature TN � 85–88 K [1–4], possessing a hexa- gonal crystal structure of AlB2 type. As it follows from the neutron diffraction study on a single crystal, CrB2 has a complicated helicoidal magnetic structure, and the mag- netic moment (of about 0.5 � B per Cr atom at T � 0) turns in ac plane [5]. The electronic specific heat coefficient of CrB2, � � 13.6 mJ/(K2�mol) [3], is abnormally high in com- parison with those of the nonmagnetic 3d-metal diborides such as ScB2, TiB2, VB2 (1–5 mJ/(K2�mol) [2,3,6]). The electronic spin susceptibility of CrB2 is also an order of magnitude higher than that of other diborides, demon- strating a large exchange-enhancement effect. The band structure calculations for CrB2 [7–10] have shown that its Fermi level lies in a region of the high density of elec- tronic states (DOS). Therefore the Stoner criterion is nearly fulfilled in CrB2, and the susceptibility enhance- ment factor, S � 9, was estimated [7,9]. In addition, the spin density wave (SDW) along the hexagonal axis was predicted in Ref. 7 to be due to the nesting of the 7th-band Fermi surface. However, both the predicted SDW type of magnetic structure and the estimated magnetization of � � 0.01�B per Cr atom are inconsistent with the experi- mental neutron data [5]. It should be noted that more rea- sonable value of magnetization, � �� 0 3. B per Cr atom, was obtained in the recent spin-polarized band structure calculations for CrB2 [10]. Here we report results of our investigations of the pressure effect on the magnetic susceptibility and Néel temperature of CrB2 compound to clarify the nature of its magnetic properties and details of the antiferromagnetic (AFM) transition. The experimental data are supple- mented by ab initio calculations of the volume dependent band structure and magnetic susceptibility. © G.E. Grechnev, A.S. Panfilov, A.V. Fedorchenko, V.B. Filippov, A.B. Lyashchenko, and A.N. Vasiliev, 2009 2. Experimental details and results The polycrystalline sample of CrB2 compound was initially prepared by arc-melting of the stoichiometric amount of Cr and B elements of better than 99.8% purity in a water cooled crucible under protective argon atmo- sphere. The ingot was then crushed to powder and pres- surized. The pressed sample was sintered at T � 1500 °C followed by its melting in an inductance furnace and an- nealing. The study of x-ray powder diffraction at room temperature revealed that sample has the AlB2-type hex- agonal crystal structure, and the obtained lattice parame- ters agree closely with that published in literature [11]. Any other phases were not detected within the resolution of the employed x-ray technique. For additional examination of the sample quality, its magnetic susceptibility was measured as a function of temperature for the magnetic field H � 0.8 T using the Faraday microbalance method. The data obtained show a clear peak at T � 87 K (see Fig. 1), which corresponds to magnetic ordering in the system. The observed �( )T be- havior is in agreement with the known literature data for the high quality CrB2 samples [4]. The pressure effect on the magnetic susceptibility was measured under helium gas pressure up to 2 kbar at two fixed temperatures, 78 and 300 K, using a pendulum-type magnetometer placed into the nonmagnetic pressure cell [12]. The relative errors of our measurements, performed in the magnetic field H = 1.7 T, did not exceed 0.05%. The experimental pressure dependencies of the magnetic sus- ceptibility of CrB2 are shown in Fig. 2, which demon- strate a magnitude of the pressure effect and its linear be- havior. For each temperature the values of � at ambient pressure and their pressure derivatives d /dPln � are listed in Table 1. In order to transform the pressure derivative into the volume one, we used the calculated bulk modulus value (B = 2.3 Mbar, see Sec. 3.1). Table 1. The magnetic susceptibility of CrB2 (in 10 –4 emu/mol) and its pressure (in Mbar –1 ) and volume derivatives at different temperatures T, K � d ln �/dP d ln �/d ln V exp. theor. a exp. exp. theor. a 0 7.3 b 7.5 – – 4.0 78 6.42 – –1.82 � 0.3 –4.2 � 0.7 – 300 5.11 – –1.65 � 0.2 –3.8 � 0.5 – a for paramagnetic state; b extrapolation of the experimental data for paramagnetic state in Fig. 1. With the aim of finding the pressure effect on the Néel temperature, the �( )T dependence was studied in detail around TN for two different pressures (see Fig. 3). The re- sulting pressure derivative dT /dPN � (0.1 � 0.1) K/kbar was estimated from a shift of the maximum in �( )T and appears to show only weak tendency for an increase of TN with pressure. 3. Computational method and results 3.1. Band structure calculations The investigated diboride CrB2 possesses the hexago- nal AlB2 (C32) crystal structure which is composed of transition metal layers alternating with graphite-like bo- ron layers stacked perpendicularly to the [ ]001 axis. Ab ini- tio calculations of the electronic structure of CrB2 were carried out by employing a modified FP-LMTO method [13–15]. The exchange-correlation potential was treated 678 Fizika Nizkikh Temperatur, 2009, v. 35, No. 7 G.E. Grechnev, A.S. Panfilov, A.V. Fedorchenko, V.B. Filippov, A.B. Lyashchenko, and A.N. Vasiliev 6.5 6.0 5.5 5.0 0 50 100 150 200 250 300 T, K T = 87 KN �, 1 0 em u /m o l – 4 Fig. 1. Temperature dependence of the magnetic susceptibility for CrB2. The data obtained with pendulum magnetometer at P � 0 are presented by filled squares. 1.000 0.999 0.998 0.997 0.996 0 0.5 1.0 1.5 2.0 P, kbar � � (P )/ (0 ) 78 K 300 K Fig. 2. Pressure dependence of the magnetic susceptibility for CrB2 at T � 78 and 300 K normalized to its value at P � 0. in the local density approximation (LDA) [16] of the den- sity functional theory. The calculated density of states N E( ) for the paramag- netic (PM) phase of CrB2 is shown in Fig. 4, and it is in a qualitative agreement with the results of KKR-ASA [7] and LMTO-ASA [8–10] calculations. The calculated DOS at the Fermi level N EF( ) � 31.7 Ry–1 is comparable with the results of LMTO-ASA calculations, 33.7 [8] and 34.9 [10] Ry–1, but differs substantialy from the earlier result of non-self-consistent calculations of Ref. 7, N EF( ) � 20.9 Ry–1. As seen from Fig. 4, in CrB2 the Fermi level is located at the steep slope of N E( ) peak where DOS rapidly grows with energy. Among other 3d-diborides CrB2 possesses a comparatively large value of N EF( ), resulting in a strongly enhanced spin paramag- netism of the compound and transition to the magnetically ordered state at T = 87 K. In order to evaluate the bulk modulus value to be used in the analysis of the pressure effects in CrB2, the band structure calculations were performed for a number of lat- tice parameters close to the experimental ones (the ratio c/a was fixed at its experimental value 1.033). The equi- librium unit cell volume V th and the corresponding theo- retical bulk modulus BLDA were determined from the cal- culated volume dependence of the total energy E V( ) by using the well known Murnaghan equation [14], and ap- pear to be V th � 21.79 � 3 and BLDA � 3.23 Mbar. The Murnaghan equation is based on the assumption that the pressure derivative �B of the bulk modulus B is constant. By using the evaluated from the Murnaghan equation value of � �B 3.9, we have estimated B � 2.3 Mbar, correspond- ing to the experimental volume Vexp = 23.41 � 3 [17]. This correction counterbalances the well known over-bonding tendency of the LDA approach [14], and provides better agreement with experimental values of bulk moduli, as it comes from our previous calculations [13,15]. 3.2. Magnetic susceptibility The FP-LMTO calculations of the field-induced spin and orbital (Van Vleck) magnetic moments were carried out self-consistently within the procedure described in Refs. 13, 15 by means of the Zeeman operator, � ( � �)H Z � � H s l2 , (1) which was incorporated in the original FP-LMTO Hamiltonian. Here H is the external magnetic field, �s and �l are the spin and orbital angular momentum operators, re- spectively. The field induced spin and orbital magnetic moments were calculated in the external field of 10 T and provided estimation of the related contributions to the magnetic susceptibility, �spin and �orb . For the hexagonal C32 crystal structure of CrB2, the components of these contributions, � i || and � i , were derived from the mag- netic moments obtained in an external field, applied par- allel and perpendicular to the c axis, respectively. The averaged values of the calculated �spin and �orb compo- nents, � � �i i i /� ( )|| 2 3, and the evaluated magnetic anisotropy, which is determined by the orbital contribu- tion, �� � �orb orb orb� � || , are listed in Table 2. For com- pleteness, the table contains also an estimate of the Langevin diamagnetism of filled shells �dia which ap- pears to be close to a free-ionic diamagnetic susceptibility [18,19]. In addition, the enhanced Pauli spin contribution to the magnetic susceptibility was also calculated within the Stoner model: � � �ston � � �S N E IN EP B F F 2 11( )[ ( )] , (2) Effect of pressure on the magnetic properties of CrB2 Fizika Nizkikh Temperatur, 2009, v. 35, No. 7 679 P = 1.7 kbar P = 0.1 kbar dT /dP = 0.1 0.1 K/kbarN � 6.48 6.46 6.44 6.42 6.40 80 85 90 95 T, K �, 1 0 em u /m o l – 4 Fig. 3. Temperature dependence of the magnetic susceptibility for CrB2 in the vicinity of TN at two fixed pressures. 0.8 1.0 1.2 Energy, Ry 0 20 40 60 N (E ), st at es /R y CrB2 ScB2 VB2 MnB2 EF TiB2 1.4 Fig. 4. Density of states for CrB2. The vertical lines indicate the conduction band filling for the corresponding 3d diborides. where � P = � B FN E2 ( ), S is the Stoner enhancement fac- tor, and � B is the Bohr magneton. The Stoner integral I, describing the exchange-correlation interaction of the conduction electrons, can be expressed in terms of the calculated parameters of the electronic structure [20,21]: I N E N E J N E F ql qll F qll ql F� � � ��1 2( ) ( ) ( ). (3) Here N EF( ) is the total density of electronic states at the Fermi level EF , N Eql F( ) is the partial density of states for atom q in the unit cell, J qll� are the local exchange integrals: J g r r r drll l l� �� � �� ( ( )) ( ) ( )� 2 2 , (4) where �l r( ) are the partial wave functions, and g r( ( ))� is a function of the charge density [16]. The calculated value of the enhanced Pauli susceptibility �ston is presented in Table 2 and appears to be lower than the field-induced spin susceptibility �spin , evaluated by using the full Zeeman term (1). It should be noted, that the field-in- duced and Pauli spin susceptibilities in Table 2 were cal- culated for the equilibrium unit cell volume V th . 4. Discussion In CrB2 the main contribution to N EF( ) comes from d states of Cr, and the Stoner criterion is nearly fulfilled due to the large value of N EF( ) (see Fig. 4). The calculated susceptibility enhancement factor S IN EF� � �[ ( )]1 1 ap- pears to be about 8, which is comparable with earlier esti- mations (S � 9 [7]). In the PM phase of CrB2 the magnetic susceptibility rises with decreasing temperature and becomes �exp � 6.5�10–4 emu/mol at T � 90 K. The extra- polated PM susceptibility �exp ( )T � 0 provides the es- timation �exp ( )0 � 7.3�10–4 emu/mol, which is in agree- ment with the calculated paramagnetic contributions �spin and �orb from Table 2. The calculated small value of the magnetic anisotropy in CrB2 (less than 1%) is also in line with the experimental data of Ref. 4. The total susceptibility of metallic systems in the ab- sence of spontaneous magnetic moment can be expressed as the sum ([15,19]): � � � � �tot spin orb dia� L, (5) which, along with the above mentioned contributions, also includes the diamagnetism of conduction electrons � L. A rigorous calculation of � L is rather difficult prob- lem for a complicated band structure (see, e.g., [22]), and the free-electron Landau limit is often used for estima- tions, though for many systems this crude approximation was found not to provide even the correct order of magni- tude of the diamagnetic susceptibility. In fact, the agree- ment of the contributions to the magnetic susceptibility � � � �sum spin orb dia� calculated here (see Table 2) with the experimental value of � (Table 1) gives evidence that for CrB2 the diamagnetic contribution � L is presum- ably negligible as compared with the dominating spin contribution �spin . In order to analyse the experimental data on pressure effect in the magnetic susceptibility, the volume depend- encies of the paramagnetic contributions to susceptibility �spin and �orb are calculated ab initio within the field-in- duced FP-LMTO technique. The evaluated volume deriva- t i v e d /d Vln( ) ln .� �spin orb � 4 0 a p p e a r s t o b e i n agreement with the experimental result for the PM phase of CrB2, d /d Vln ln . .� � �3 8 0 5 (see Table 1). It should be pointed out that the calculated value of the pressure effect on � is predominately determined by the enhanced spin contribution �spin . The measured pressure derivative of the magnetic sus- ceptibility d /dPln � can be used to derive the spontaneous volume change in CrB2 due to the antiferromagnetic or- dering �V/V m � which relates to the squared local mag- netic moment M T2( ) ([23]): �m T C B M T( ) ( )� 2 . (6) Here B is the bulk modulus, C is the magnetoelastic cou- pling constant. The latter can be determined within the phenomenological relation [24]: C B V d dPm � � 1 2� �ln , (7) where � and Vm are the molar susceptibility and volume, respectively. By using in Eq. (7) the experimental values of � and d /dPln � from Table 1 and Vm � 14.1 cm3, one estimates the magnetoelastic constant to be temperature independent within experimental errors and equal to: C/B /� � � � �( . . ) ( )1 07 0 15 10 10 2emu mol . The substitution of the evaluated C/B value and the experimental mag- netic moment M /B( ) .0 0 5� � Cr [5] in Eq. (6) yields the volume change under the AFM transition to be �m( ) ( . . )0 0 083 0 012� � %. This estimate agrees closely with the experimental value �m( )0 � 0.085% [25]. 680 Fizika Nizkikh Temperatur, 2009, v. 35, No. 7 G.E. Grechnev, A.S. Panfilov, A.V. Fedorchenko, V.B. Filippov, A.B. Lyashchenko, and A.N. Vasiliev Table 2. Calculated bulk modulus B and contributions to the mag- netic susceptibility of CrB2 in PM state (see text for details) B, Mbar �ston �spin �orb ��orb �dia �sum a 10 –4 emu/mol 2.30 4.0 7.03 0.60 0.010 –0.10 7.53 �sum a = �spin + �orb + �dia The pressure dependence of the Néel temperature can be examined in line with a phenomenological approach of Ref. 26, which has been applied to the AFM chromium: T /N � exp ( )�1 � , (8) where kTB is of the order of the d-band width, and � � IN EF( ). The volume dependence of the Stoner pro- duct IN EF( ) can be obtained according to Eq. (2), which gives d d V d N E d V S d IN E d V F Fln ln ln ( ) ln ( ) ln[ ( )] ln � � �1 . (9) By substituting the experimental data on d /d Vln ln� from Table 1 into Eq. (9) together with our estimates d N E /d VFln ( ) ln = 1.52 and S � 8, we obtain d IN E d V Fln[ ( )] ln .� 0 3, (10) which means a substantial cancellation of the volume ef- fects on the density of states at the Fermi level and the ex- change parameter in the Stoner product IN EF( ) of CrB2. Therefore, according to Eq. (8), the effect of pressure on TN is mainly determined by the band width behavior, d T /dP d T /dPN Bln ln� , and appears to be rather small and positive in sign. This is consistent with the measured weak pressure dependence of the Néel temperature in CrB2 (dT /dPN � �( . . )0 1 0 1 K/kbar). It should be noted, that such behavior of TN differs essentially from that for pure chromium, where the strong suppression of the AFM state under pressure with dT /dPN � –5.1 K/kbar has been reported [26]. Therefore we can presume, that a different mechanism of the magnetic ordering takes place in CrB2 as compared to the AFM chromium. To shed more light on the nature of the magnetic order- ing in CrB2, the electronic structure calculations for its low temperature helical magnetic structure are required. Such calculations are extremely difficult to perform, and in the present work the spin-polarized electronic structure calculations are carried out for the ferromagnetic phase of CrB2. These calculations provided the spontaneous mag- netic moment of 0 8. � B , in a reasonable agreement with the experiment [5]. 5. Conclusions For the first time the pressure effect on the magnetic susceptibility of CrB2 is measured at temperatures both above and below TN � 87 K, and it is found to be almost independent on the magnetic state of the sample. Based on the obtained pressure derivative of the magnetic sus- ceptibility, we evaluated the magnetoelastic coupling constant, which appears to describe correctly the reported spontaneous volume change in CrB2 due to the anti- ferromagnetic ordering. The measured pressure effect on the Néel temperature is found to be considerably smaller than that for the pure AFM chromium, and this indicates that different mechanisms govern magnetic ordering in CrB2 and Cr. It is found that the Stoner approach underestimates substantially the spin susceptibilty for the PM phase of CrB2. This is presumably related to deficiency of the Stoner approach, when both parameters involved in the susceptibility enhancement, N EF( ) and I, are calculated and averaged over the band states separately. It should be noted that such response function as � is microscopically not uniform in space, and induced magnetization density varies considerably within the unit cell. On the other hand, our ab initio calculations in an external magnetic field provided the main contributions to the magnetic sus- ceptibility of CrB2 and allowed to describe the large value of � and the magneto-volume effect d /d Vln ln� in agree- ment with the experiment. The authors thank Prof. I.V. Svechkarev and Dr. A. Grechnev for fruitful discussions and comments. This work has been supported by the Russian–Ukrainian RFBR-NASU project 8-2009. 1. R.G. Barnes and R.B. Creel, Phys. Lett. A29, 203 (1969). 2. J. Castaing, J. Danan, and M. Rieux, Solid State Commun. 10, 563 (1972). 3. J. Castaing, P. Costa, M. Heritier, and P. Lederer, J. Phys. Chem. Solids 33, 533 (1972). 4. G. Balakrishnan, S. Majumdar, M.R. Lees, and D.M c K. Paul, J. Crystal Growth 274, 294 (2005). 5. S. Funahashi, Y. Hamaguchi, T. Nanaka, and E. Bannai, Solid State Commun. 23, 859 (1977). 6. J. Castaing, R. Caudron, G. Toupance, and P. Costa, Solid State Commun. 7, 1453 (1969). 7. S.H. Liu, L. Kopp, W.B. England, and H.W. Myron, Phys. Rev. B11, 3463 (1975). 8. X.B. Wang, D.C. Tian, and L.L. Wang, J. Phys.: Condens. Matter 6, 10185 (1994). 9. G.E. Grechnev, N.V. Ushakova, P.D. Kervalishvili, G.G. Kvachantiradze, and K.S. Kharebov, Fiz. Nizk. Temp. 23, 296 (1977) [Low Temp. Phys. 23, 217 (1997)]. 10. P. Vajeeston, P. Ravindran, C. Ravi, and R. Asokamani, Phys. Rev. B63, 045115 (2001). 11. T.Y. Kosolapova, Handbook of High Temperature Com- pounds: Properties, Production, Applications, Hemisphere Pub. Corp., N.Y. (1990). 12. A.S. Panfilov, Physics and Technics of High Pressures 2, 61 (1992). 13. G.E. Grechnev, A.S. Panfilov, I.V. Svechkarev, A. Delin, B. Johansson, J.M. Wills, and O. Eriksson, J. Magn. Magn. Mater. 192, 137 (1999). 14. J.M. Wills, O. Eriksson, M. Alouani, and D.L. Price, in: Electronic Structure and Physical Properties of Solids: the Uses of the LMTO Method, H. Dreysse (ed.), Springer, Berlin (2000), p. 148. 15. G.E. Grechnev, R. Ahuja, and O. Eriksson, Phys. Rev. B68, 64414 (2003). Effect of pressure on the magnetic properties of CrB2 Fizika Nizkikh Temperatur, 2009, v. 35, No. 7 681 16. U. von Barth and L. Hedin, J. Phys. C5, 1629 (1972). 17. K.E. Spear, J. Less-Common Metals 47, 195 (1976). 18. P.W. Selwood, Magnetochemistry, Interscience, N.Y. (1956). 19. J. Banhart, H. Ebert, J. Voitlander, and H. Winter, J. Magn. Magn. Mater. 61, 221 (1986). 20. L. Nordström, O. Eriksson, M.S.S. Brooks, and B. Johansson, Phys. Rev. B41, 9111 (1990). 21. G.E. Grechnev, A.V. Logosha, I.V. Svechkarev, A.G. Kuchin, Yu.A. Kulikov, P.A. Korzhavyi, and O. Eriksson, Fiz. Nizk. Temp. 32, 1493 (2006) [Low Temp. Phys. 32, 1140 (2006). 22. H. Fukuyama, Progr. Theor. Phys. 45, 704 (1971). 23. E. Fawcett and V.B. Pluzhnikov, Physica B119, 161 (1983). 24. T.F.M. Kortekaas and J.J.M. Franse, J. Phys. F: Metal Phys. 6, 1161 (1976). 25. Y. Nishihara, M. Tokumoto, Y. Yamaguchi, and S. Ogawa, J. Phys. Soc. Jpn. 56, 1562 (1987). 26. D.B. McMhan and T.M. Rice, Phys. Rev. Lett. 19, 846 (1967). 682 Fizika Nizkikh Temperatur, 2009, v. 35, No. 7 G.E. Grechnev, A.S. Panfilov, A.V. Fedorchenko, V.B. Filippov, A.B. Lyashchenko, and A.N. Vasiliev