| ²é¿´: 945 | »Ø¸´: 7 | |||
| ¡¾½±Àø¡¿ ±¾Ìû±»ÆÀ¼Û2´Î£¬×÷ÕßsuhangÔö¼Ó½ð±Ò 1.5 ¸ö | |||
| µ±Ç°Ö÷ÌâÒѾ´æµµ¡£ | |||
| µ±Ç°Ö»ÏÔʾÂú×ãÖ¸¶¨Ìõ¼þµÄ»ØÌû£¬µã»÷ÕâÀï²é¿´±¾»°ÌâµÄËùÓлØÌû | |||
[×ÊÔ´]
¹ØÓÚÃܶȷºº¯µÄ»ù´¡ÐÔÎÄÕÂ
|
|||
|
A new mixing of Hartree¨CFock and local density-functional theories On the parameterization of the local correlation functional_What is Becke-3-LYP On the parameterization of the local correlation functional. What is Becke-3-LYP Development of the Colle-Salvetti correlation-energy formula into a functional of the electron density Exchange functionals with improved long-range behavior and adiabatic connection methods without adjustable parameters_The mPW and mPW1PW models Adiabatic Connection for Kinetics Density-functional thermochemistry. IV. A new dynamical correlation functional and implications for exact-exchange mixing Density-functional thermochemistry. III. The role of exact exchange Density-functional thermochemistry. II. The effect of the Perdew¨CWang generalized-gradient correlation correction Density-functional thermochemistry. I. The effect of the exchange-only gradient correction Density-functional exchange-energy approximation with correct asymptotic behavior Density-functional approximation for the correlation energy o the inhomogeneous electron gas Calculations of Isotropic Hyperfine Coupling Constants of Organic Radicals. An Evaluation of Semiempirical, Hartree-Fock, and Density Functional Methods [ Last edited by fenghbu on 2007-10-2 at 15:10 ] |
» ÊÕ¼±¾ÌûµÄÌÔÌûר¼ÍƼö
ÏȽø²ÄÁÏÓë·Ö×ÓÄ£Äâ |
» ²ÂÄãϲ»¶
344Çóµ÷¼Á
ÒѾÓÐ8È˻ظ´
ҩѧר˶µ÷¼Á
ÒѾÓÐ11È˻ظ´
»¯Ñ§070300 Çóµ÷¼Á
ÒѾÓÐ25È˻ظ´
297£¬¹¤¿Æµ÷¼Á?ºÓÄÏũҵ´óѧ±¾¿Æ
ÒѾÓÐ13È˻ظ´
307ÖÐÒ½¿¼Ñе÷¼Á
ÒѾÓÐ5È˻ظ´
Çóµ÷¼Á
ÒѾÓÐ24È˻ظ´
Ò»Ö¾Ô¸»¦9£¬ÉúÎïѧ326Çóµ÷¼Á
ÒѾÓÐ8È˻ظ´
0854Çóµ÷¼Á
ÒѾÓÐ19È˻ظ´
294Çóµ÷¼Á
ÒѾÓÐ11È˻ظ´
Ò»Ö¾Ô¸»ªÖÐũҵ071010£¬320Çóµ÷¼Á
ÒѾÓÐ14È˻ظ´
tianlangxingaa
Ìú¸Ëľ³æ (ÖøÃûдÊÖ)
- Ó¦Öú: 52 (³õÖÐÉú)
- ¹ó±ö: 0.02
- ½ð±Ò: 7464.2
- Ìû×Ó: 1283
- ÔÚÏß: 735.1Сʱ
- ³æºÅ: 438857
3Â¥2007-10-02 16:09:22
tianlangxingaa
Ìú¸Ëľ³æ (ÖøÃûдÊÖ)
- Ó¦Öú: 52 (³õÖÐÉú)
- ¹ó±ö: 0.02
- ½ð±Ò: 7464.2
- Ìû×Ó: 1283
- ÔÚÏß: 735.1Сʱ
- ³æºÅ: 438857
2Â¥2007-09-30 11:37:01
6Â¥2007-10-05 08:18:07
7Â¥2007-10-05 08:27:16













»Ø¸´´ËÂ¥






