±±¾©Ê¯ÓÍ»¯¹¤Ñ§Ôº2026ÄêÑо¿ÉúÕÐÉú½ÓÊÕµ÷¼Á¹«¸æ

ͶƱ±êÌâ: ¡¾µ÷²é¡¿±È½ÏÀÖÒâ½ÓÊܵÚÒ»ÐÔÔ­Àí¼ÆËãµÄÔÓÖ¾ (¶àÑ¡)

  • 1¡¢The Journal of Chemical Physics ÍøÖ·£ºhttp://jcp.aip.org/
    400 (10.2%)
  • 2¡¢The Journal of Physics Chemical ÍøÖ·£ºhttp://pubs.acs.org/journal/jpcbfk?co
    252 (6.4%)
  • 3¡¢Chemical Physics ÍøÖ·£ºhttp://www.elsevier.com/wps/find/journaldescription.c
    82 (2.1%)
  • 4¡¢The Journal of Physics B ÍøÖ·£ºhttp://www.iop.org/EJ/journal/jphysb
    85 (2.2%)
  • 5¡¢Physics Review B ÍøÖ·£ºhttp://prb.aps.org/
    525 (13.4%)
  • 6¡¢Physical Review letters ÍøÖ·£ºhttp://prl.aps.org/
    239 (6.1%)
  • 7¡¢Nature materials ÍøÖ·£ºhttp://www.nature.com/nmat/index.html
    71 (1.8%)
  • 8¡¢Journal of Alloys and Compounds ÍøÖ·£ºhttp://www.elsevier.com/wps/find/journa
    75 (1.9%)
  • 9¡¢Surface Science ÍøÖ·£ºhttp://www.elsevier.com/wps/find/journaldescription.cws
    93 (2.4%)
  • 10¡¢Chinese Physics Letters ÍøÖ·£ºhttp://www.iop.org/EJ/journal/Cpl
    85 (2.2%)
  • 11¡¢Journal of applied physics ÍøÖ·£ºhttp://jap.aip.org/jap/
    114 (2.9%)
  • 12¡¢Journal of physics-condensed matter ÍøÖ·£ºhttp://www.iop.org/EJ/journal/JPhy
    75 (1.9%)
  • 13¡¢Physics Letters A ÍøÖ·£ºhttp://www.elsevier.com/wps/find/journaldescription.
    76 (1.9%)
  • 14¡¢Chemical Physics Letters ÍøÖ·£ºhttp://www.elsevier.com/wps/find/journaldescr
    105 (2.7%)
  • 15¡¢Applied Physics Letters ÍøÖ·£ºhttp://apl.aip.org/
    157 (4%)
  • 16¡¢Computational Materials Science ÍøÖ·£ºhttp://www.elsevier.com/wps/find/journ
    154 (3.9%)
  • 17¡¢Solid State Communications ÍøÖ·£ºhttp://www.elsevier.com/wps/find/journaldes
    104 (2.6%)
  • 18¡¢Solid State Sciences ÍøÖ·£ºhttp://www.elsevier.com/wps/find/journaldescripti
    43 (1.1%)
  • 19¡¢The Journal of Physical Chemistry A ÍøÖ·£ºhttp://pubs.acs.org/journal/jpcaf
    55 (1.4%)
  • 20¡¢Journal of Molecular Structure ÍøÖ·£ºhttp://www.elsevier.com/wps/find/journa
    35 (0.9%)
  • 21¡¢Journal of computational chemistry ÍøÖ·£ºhttp://as.wiley.com/WileyCDA/WileyT
    74 (1.9%)
  • 22¡¢Journal of chemical theory and computation ÍøÖ·£ºhttp://pubs.acs.org/journal
    53 (1.3%)
  • 23¡¢Physica status solidi (b) ÍøÖ·£ºhttp://www3.interscience.wiley.com/journal/4
    40 (1%)
  • 24¡¢Physica status solidi (RRL) - Rapid Research Letters ÍøÖ·£ºhttp://www3.inter
    31 (0.8%)
  • 25¡¢Physica status solidi (a) ÍøÖ·£ºhttp://www3.interscience.wiley.com/journal/4
    21 (0.5%)
  • 26¡¢Physica status solidi (c) ÍøÖ·£ºhttp://www3.interscience.wiley.com/journal/1
    17 (0.4%)
  • 27¡¢Physical Chemistry Chemical Physics ÍøÖ·£ºhttp://www.rsc.org/Publishing/Jour
    83 (2.1%)
  • 28¡¢Physics Review A ÍøÖ·£ºhttp://pra.aps.org/
    29 (0.7%)
  • 29¡¢Journal of Catalysis ÍøÖ·£ºhttp://www.elsevier.com/wps/find/journaldescripti
    25 (0.6%)
  • 30¡¢Journal of the American Chemical Society ÍøÖ·£ºhttp://pubs.acs.org/journal/j
    51 (1.3%)
  • 31¡¢Physica B: Condensed Matter ÍøÖ·£ºhttp://www.elsevier.com/wps/find/homepage.
    101 (2.6%)
  • 32¡¢Journal of Physics and Chemistry of Solids ÍøÖ·£ºhttp://www.elsevier.com/wps
    36 (0.9%)
  • 33¡¢The Journal of Physical Chemistry B ÍøÖ·£ºhttp://pubs.acs.org/journal/jpcbf
    62 (1.6%)
  • 34¡¢Applied Surface Science ÍøÖ·£º http://www.elsevier.com/wps/find/journaldesc
    71 (1.8%)
  • 35¡¢The Journal of Physical Chemistry C ÍøÖ·£º http://pubs.acs.org/journal/jpcC
    167 (4.2%)
  • 36¡¢±¸ÓÃ
    100 (2.5%)
  • 37¡¢±¸ÓÃ
    8 (0.2%)
  • 38¡¢±¸ÓÃ
    9 (0.2%)
  • 39¡¢±¸ÓÃ
    9 (0.2%)
  • 40¡¢±¸ÓÃ
    119 (3%)
²é¿´: 44370  |  »Ø¸´: 185
µ±Ç°Ö»ÏÔʾÂú×ãÖ¸¶¨Ìõ¼þµÄ»ØÌû£¬µã»÷ÕâÀï²é¿´±¾»°ÌâµÄËùÓлØÌû

wuli8

ÈÙÓþ°æÖ÷ (ÖªÃû×÷¼Ò)

¡­¡­¡­¡­

ÓÅÐã°æÖ÷ÓÅÐã°æÖ÷

[½»Á÷] ¡¾µ÷²é¡¿±È½ÏÀÖÒâ½ÓÊܵÚÒ»ÐÔÔ­Àí¼ÆËãµÄÔÓÖ¾ ÒÑÓÐ84È˲ÎÓë

1¡¢The Journal of Chemical Physics  ÍøÖ·£ºhttp://jcp.aip.org/
2¡¢The Journal of  Physics Chemical  ÍøÖ·£ºhttp://pubs.acs.org/journal/jpcbfk?cookieSet=1
3¡¢Chemical Physics  ÍøÖ·£ºhttp://www.elsevier.com/wps/find ... ription#description
4¡¢The Journal of Physics B ÍøÖ·£ºhttp://www.iop.org/EJ/journal/jphysb
5¡¢Physics Review B ÍøÖ·£ºhttp://prb.aps.org/
6¡¢Physical Review letters ÍøÖ·£ºhttp://prl.aps.org/
7¡¢Nature materials ÍøÖ·£ºhttp://www.nature.com/nmat/index.html
8¡¢Journal of Alloys and Compounds ÍøÖ·£ºhttp://www.elsevier.com/wps/find ... ription#description
9¡¢Surface Science ÍøÖ·£ºhttp://www.elsevier.com/wps/find ... ription#description
10¡¢Chinese Physics Letters ÍøÖ·£ºhttp://www.iop.org/EJ/journal/Cpl
11¡¢Journal of applied physics ÍøÖ·£ºhttp://jap.aip.org/jap/
12¡¢Journal of physics-condensed matter ÍøÖ·£ºhttp://www.iop.org/EJ/journal/JPhysCM
13¡¢Physics Letters A ÍøÖ·£ºhttp://www.elsevier.com/wps/find ... ription#description
14¡¢Chemical Physics Letters ÍøÖ·£ºhttp://www.elsevier.com/wps/find ... ription#description
15¡¢Applied Physics Letters ÍøÖ·£ºhttp://apl.aip.org/
16¡¢Computational Materials Science ÍøÖ·£ºhttp://www.elsevier.com/wps/find ... ription#description
17¡¢Solid State Communications ÍøÖ·£ºhttp://www.elsevier.com/wps/find ... ription#description
18¡¢Solid State Sciences ÍøÖ·£ºhttp://www.elsevier.com/wps/find ... ription#description
19¡¢The Journal of Physical Chemistry A  ÍøÖ·£ºhttp://pubs.acs.org/journal/jpcafh
20¡¢Journal of Molecular Structure ÍøÖ·£ºhttp://www.elsevier.com/wps/find ... ription#description
21¡¢Journal of computational chemistry ÍøÖ·£ºhttp://as.wiley.com/WileyCDA/WileyTitle/productCd-JCC.html
22¡¢Journal of chemical theory and computation ÍøÖ·£ºhttp://pubs.acs.org/journal/jctcce
23¡¢Physica status solidi (b) ÍøÖ·£ºhttp://www3.interscience.wiley.com/journal/40001185/home
24¡¢Physica status solidi (RRL) - Rapid Research Letters ÍøÖ·£ºhttp://www3.interscience.wiley.com/journal/112716025/home
25¡¢Physica status solidi (a) ÍøÖ·£ºhttp://www3.interscience.wiley.com/journal/40000761/home
26¡¢Physica status solidi (c) ÍøÖ·£ºhttp://www3.interscience.wiley.c ... grouphome/home.html
27¡¢Physical Chemistry Chemical Physics ÍøÖ·£ºhttp://www.rsc.org/Publishing/Journals/CP/index.asp
28¡¢Physics Review A ÍøÖ·£ºhttp://pra.aps.org/
29¡¢Journal of Catalysis ÍøÖ·£ºhttp://www.elsevier.com/wps/find ... ription#description
30¡¢Journal of the American Chemical Society ÍøÖ·£ºhttp://pubs.acs.org/journal/jacsat
31¡¢Physica B: Condensed Matter ÍøÖ·£ºhttp://www.elsevier.com/wps/find/homepage.cws_home
32¡¢Journal of Physics and Chemistry of Solids ÍøÖ·£ºhttp://www.elsevier.com/wps/find ... ription#description
33¡¢The Journal of Physical Chemistry B  ÍøÖ·£ºhttp://pubs.acs.org/journal/jpcbfk

34¡¢Applied Surface Science  ÍøÖ·£º http://www.elsevier.com/wps/find ... ription#description
35¡¢The Journal of Physical Chemistry C  ÍøÖ·£º http://pubs.acs.org/journal/jpcCfk

nanotechnology

[ Last edited by wuli8 on 2011-8-9 at 23:47 ]
»Ø¸´´ËÂ¥

» ÊÕ¼±¾ÌûµÄÌÔÌûר¼­ÍƼö

¿ÆÑй¤¾ß×ÊÔ´Nick µÚÒ»ÐÔÔ­Àí¼ÆËã×ÊÔ´×ܻ㠵ÚÒ»ÐÔÔ­Àí VASP
µÚÒ»ÐÔÔ­ÀíÏà¹ØÎĵµ MSµÚÒ»ÐÔÔ­Àí ¾§ÌåÄ£ÐͼÆËã·ÖÎö µÚÒ»Ô­Àí×ÊÁÏÌù
vasp µÚÒ»ÐÔÔ­Àí Ä£Äâ֪ʶ»ã×Ü MSÖ®CASTEPÄ£¿éÔËÓÃ
ľ³æ¿Î¼þ µÚÒ»ÐÔÔ­Àí£¬MS£¬¸ß˹ materials studioϵÁÐ @¸öÈËÊÕ¼¯@
µÚÒ»ÐÔÔ­Àí VASP¼ÆËã×ÊÁÏÊÕ¼¯byZF Gaussian ´Ì¿Í
ij併ļÐ×Ó ´ß»¯µç¼«²ÄÁÏ Ë¶Ê¿ÊÕ²Ø Ñ§Ï°
ÎҵķÖÏí µÚÒ»ÐÔÔ­Àí¸ÅÄî¼°Ïà¹ØÄÚÈÝ chelleµÄ¿ÆÑÐ֮· ×ÊÁÏÊÕ²Ø
»ù´¡ÖªÊ¶ ¼ÆËãÄ£Äâ ÊÕ²Ø ÔÓÆßÔÓ°Ë
CASTEP ÂÛÎÄͶ¸å Éó¸åÈ˽¨Òé+ÂÛÎĹ淶 µÚÒ»ÐÔÔ­Àí
Á¿»¯Ñ§Ï° ѧϰ±¸Óà First Principle LIBÖ®LFS
¼ÆËã µÚÒ»ÐÔÔ­Àí ר¼­ µÚÒ»Ô­Àí µÚÒ»ÐÔÔ­Àí

» ±¾ÌûÒÑ»ñµÃµÄºì»¨£¨×îÐÂ10¶ä£©

» ²ÂÄãϲ»¶

» ±¾Ö÷ÌâÏà¹Ø¼ÛÖµÌùÍÆ¼ö£¬¶ÔÄúͬÑùÓаïÖú:

¡­¡­¡­¡­
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

zcjyzst

ľ³æ (ÕýʽдÊÖ)

¡ï ¡ï
Сľ³æ(½ð±Ò+0.5):¸ø¸öºì°ü£¬Ð»Ð»»ØÌû½»Á÷
wuli8(½ð±Ò+1,VIP+0):¸Ðл֧³Ö£¬»¶Ó­³£À´£¬(*^__^*) ÎûÎû¡­¡­ 6-16 21:28
¸Õ½Ó´¥µÚÒ»ÐÔÔ­Àí¼ÆËã°¡£¬Óкܶ಻̫Çå³þ
46Â¥2009-06-16 21:15:32
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû
Ïà¹Ø°æ¿éÌø×ª ÎÒÒª¶©ÔÄÂ¥Ö÷ wuli8 µÄÖ÷Ìâ¸üÐÂ
×î¾ßÈËÆøÈÈÌûÍÆ¼ö [²é¿´È«²¿] ×÷Õß »Ø/¿´ ×îºó·¢±í
[¿¼ÑÐ] 0856µ÷¼Á +3 ÇúÌýóÞ 2026-03-30 3/150 2026-03-31 07:29 by Î޼ʵIJÝÔ­
[¿¼ÑÐ] һ־ԸʳƷ¿ÆÑ§Ó빤³Ì083200Çóµ÷¼Á +4 XQTJZ 2026-03-30 4/200 2026-03-31 04:10 by fmesaito
[¿¼ÑÐ] 332Çóµ÷¼Á +14 032500 2026-03-25 14/700 2026-03-30 20:03 by Î޼ʵIJÝÔ­
[¿¼ÑÐ] 070300»¯Ñ§354Çóµ÷¼Á +7 101´ÎÏ£Íû 2026-03-28 7/350 2026-03-30 13:22 by Iveryant
[¿¼ÑÐ] Çóµ÷¼Á +7 Çà´º²ÃΪÈý½Ø 2026-03-29 7/350 2026-03-30 13:14 by laoshidan
[¿¼ÑÐ] Ò»Ö¾Ô¸Äϲý´óѧ324Çóµ÷¼Á +5 hanamiko 2026-03-29 5/250 2026-03-29 16:46 by ѧԱ8dgXkO
[¿¼ÑÐ] 298Çóµ÷¼Á +3 ÖÖÊ¥´Í 2026-03-29 3/150 2026-03-29 12:06 by longlotian
[¿¼ÑÐ] 085600£¬×¨Òµ¿Î»¯¹¤Ô­Àí£¬321·ÖÇóµ÷¼Á +5 ´ó²öС×Ó 2026-03-28 5/250 2026-03-29 08:56 by qingfeng258
[¿¼ÑÐ] 305Çóµ÷¼Á +8 RuiFairyrui 2026-03-28 8/400 2026-03-29 08:22 by fmesaito
[¿¼ÑÐ] µ÷¼Á¿¼ÑÐ +3 Íõ½ÜÒ» 2026-03-29 3/150 2026-03-29 08:09 by fmesaito
[¿¼ÑÐ] 356Çóµ÷¼Á +3 gysy?s?a 2026-03-28 3/150 2026-03-29 00:33 by 544594351
[¿¼ÑÐ] Ò»Ö¾Ô¸»ªÀí£¬ÊýÒ»Ó¢Ò»285ÇóAÇøµ÷¼Á +8 AZMK 2026-03-25 12/600 2026-03-28 18:15 by AZMK
[¿¼ÑÐ] ±¾¿ÆÐÂÄÜÔ´¿ÆÑ§Ó빤³Ì£¬Ò»Ö¾Ô¸»ªÀíÄܶ¯285Çóµ÷¼Á +3 AZMK 2026-03-27 5/250 2026-03-28 16:19 by xxxsssccc
[¿¼ÑÐ] 322Çóµ÷¼Á +5 ¾É… 2026-03-24 5/250 2026-03-28 13:26 by Iveryant
[¿¼ÑÐ] 081200-314 +3 LILIQQ 2026-03-27 4/200 2026-03-28 09:41 by ±£»¤µØÇòÄãÎÒ×öÆ
[¿¼ÑÐ] Ò»Ö¾Ô¸ÄÏʦ´ó0703»¯Ñ§ 275Çóµ÷¼Á +4 RipcordÉϰ¶ 2026-03-27 4/200 2026-03-27 17:00 by zhyzzh
[¿¼ÑÐ] 315µ÷¼Á +4 0860Çóµ÷¼Á 2026-03-26 5/250 2026-03-27 11:23 by wangjy2002
[¿¼ÑÐ] 085602»¯Ñ§¹¤³ÌÇóµ÷¼Á¡£ +4 ƽÀÖÀÖÀÖ 2026-03-26 4/200 2026-03-26 17:57 by fmesaito
[¿¼ÑÐ] 290·Öµ÷¼ÁÇóÖú +3 ¼ªÏéÖ¹Ö¹³Â 2026-03-25 3/150 2026-03-25 19:58 by barlinike
[¿¼ÑÐ] ÇóbÇøÔºÐ£µ÷¼Á +4 ÖÜ56 2026-03-24 5/250 2026-03-25 17:12 by yishunmin
ÐÅÏ¢Ìáʾ
ÇëÌî´¦ÀíÒâ¼û