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ÿ¸öMn4µ¥ÔªÖеÄËĸöMn(III)Àë×ÓÅäλ»·¾³¾ù²»Í¬£¬Ã¿Á½¸öMn(III)Àë×ÓÖ®¼äµÄÁ¬½Ó·½Ê½Ò²²»¾¡Ïàͬ£¬Mn(III)Àë×ÓÖ®¼äµÄ´ÅñîºÏ¹ØÏµ·Ç³£¸´ÔÓ£¬ÔÚ´ËΪÁ˶¨ÐԵؿ¼²ìÃÌÀë×ÓÖ®¼äµÄ´ÅÏ໥×÷ÓõÄÇ¿¶È£¬½«ËĸöÃÌÀë×ÓÖ®¼äµÄñîºÏ¹ØÏµ¼ò»¯£¬Ê¹ÓÃÒ»¸öñîºÏ³£ÊýJÀ´¿¼²ì¡£ÁíÍ⣬ΪÁ˼õÉÙ¼ÆËãÖеIJÎÊý¡¢¼ò»¯Ä£ÐÍ£¬·Ö×Ó¼äµÄͨ³£½ÏÈõµÄ´ÅÏ໥×÷Óù±Ï×ÔÚ´ËÒ²²»Ó迼ÂÇ¡£¸ù¾ÝÕýËÄÃæÌåÅÅÁеÄMnIII4Ìåϵ£¨Í¼½â1£©µÄ×ÔÐý¹þÃܶÙËã·ûĤ = -2J(Ŝ1Ŝ2+Ŝ1Ŝ4+ Ŝ2Ŝ3+ Ŝ3Ŝ4)£¬¿Éµ¼³ö¸ÃÌåϵµÄ´Å»¯Âʱí´ïʽ£¨¹«Ê½1£© The crystal structure of 1 shows that the coordination environments of four Mn(III) ions in every Mn4 units are different from each other and the bridging modes of every two Mn(III) ions are not completely the same indicate that the magnetic coupling relations between Mn(III) ions are extraordinary complicated. To qualitatively evaluate the magnitude of the magnetic interaction in manganese ions, we tried to simplify the coupling relation between the four Mn(III) ions with one coupling constant J. In general, the weaker magnetic interaction are not considered in order to reduce the calculation parameters and simplify the model. The layer can be schematically illustrated in Scheme 1. On the basis of the regular tetrahedron arrangement of MnIII4 model, the magnetic susceptibilities can be fitted accordingly by the following expression given in Equation (1) derived from the spin Hamiltonian Ĥ = -2J(Ŝ1Ŝ2+Ŝ1Ŝ4+ Ŝ2Ŝ3+ Ŝ3Ŝ4), |
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гæ (СÓÐÃûÆø)
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5Â¥2014-01-12 20:29:49
RXMCDM
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| The crystal structure of 1 shows that the coordination environments of each of the four Mn(III) ions in Mn4 unit are different and the bridging modes of each of two Mn(III) ions are not the same indicated the complicated magnetic coupling relations between Mn(III) ions . In order to qualitatively evaluate the magnitude of the magnetic interaction between manganese ions and simplify the coupling relationship between the four manganese ions,we introduced a coupling constant J.Further, in order to reduce the computational parameters and simplify the model ,the weaker magnetic interaction model molecules are not taken into account .According to tetrahedral arrangement of the MnIII4 system (Scheme 1),the magnetic susceptibilities of the system (Equation 1) can be derived from the spin Hamiltonian Ĥ = -2J(Ŝ1Ŝ2+Ŝ1Ŝ4+ Ŝ2Ŝ3+ Ŝ3Ŝ4). |

2Â¥2014-01-12 00:34:37
spiegboy
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È»memory: ½ð±Ò+5, ¡ï¡ï¡ïºÜÓаïÖú, ллÄãµÄÖ¸µã 2014-01-12 20:30:29
È»memory: ½ð±Ò+5, ¡ï¡ï¡ïºÜÓаïÖú, ллÄãµÄÖ¸µã 2014-01-12 20:30:29
|
several phrases need to be further revised. 1. much weaker molecular magnetic interactions... 2, magnetic susceptibility. (there can be only one static magnetic susceptibility in one system.) |
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3Â¥2014-01-12 13:42:28
RXMCDM
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È»memory: ½ð±Ò+15, ·ÒëEPI+1, ¡ï¡ï¡ïºÜÓаïÖú 2014-01-12 20:30:15
È»memory: ½ð±Ò+15, ·ÒëEPI+1, ¡ï¡ï¡ïºÜÓаïÖú 2014-01-12 20:30:15
|
°´ÈýÂ¥µÄ½¨Ò飬ÐÞ¸ÄÈçÏÂ,ÔÎĵÄto ¸ÄΪin order to ,Òâ˼ÊÇÒ»ÑùµÄ£¬Ö»ÊÇ˳¿ÚһЩ£¬Ò»°ã·Òëºó»¹Òª¶Áһϣ¬¸Ð¾õͨ˳ΪºÃ£¡ The crystal structure of 1 shows that the coordination environments of each of the four Mn(III) ions in Mn4 unit are different and the bridging modes of each of two Mn(III) ions are not the same indicated the complicated magnetic coupling relations between Mn(III) ions . In order to qualitatively evaluate the magnitude of the magnetic interaction between manganese ions and simplify the coupling relationship between the four manganese ions,we introduced a coupling constant J.Further, in order to reduce the computational parameters and simplify the model ,the much weaker molecular magnetic interactions are not taken into account .According to tetrahedral arrangement of the MnIII4 system (Scheme 1),the magnetic susceptibility of the system (Equation 1) can be derived from the spin Hamiltonian Ĥ = -2J(Ŝ1Ŝ2+Ŝ1Ŝ4+ Ŝ2Ŝ3+ Ŝ3Ŝ4). |

4Â¥2014-01-12 14:21:15













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