| ²é¿´: 5177 | »Ø¸´: 20 | |||
| µ±Ç°Ö»ÏÔʾÂú×ãÖ¸¶¨Ìõ¼þµÄ»ØÌû£¬µã»÷ÕâÀï²é¿´±¾»°ÌâµÄËùÓлØÌû | |||
dragonlongľ³æ (СÓÐÃûÆø)
|
[½»Á÷]
¡¾ÇóÖú¡¿VASP5.2 optical properties calculations ÒÑÓÐ15È˲ÎÓë
|
||
|
¿ªÊ¼Ñ§Ï°ÓÃVASP5.2¼ÆËã¹âѧÐÔÖÊ£¬°´ÕÕÊÖ²áÀïÃæËµÃ÷£¬ÔÚINCARÖмÓÉÏ LOPTICS = .TRUE. NBANDS = 1200 £¨×ã¹»µÄ¿Õ´ø£© Êä³öÎļþÖÐûÓÐ OPTICÎļþ¡£ ÉèÖÃÁËLDOS = T LJDOS = TÒ²µÃ²»µ½JDOS ºÍEPS¡£ ÄÄλ³É¹¦ÓÃvasp¼ÆËã¹âѧÐÔÖʵģ¬¿É·ñ˵һϼÆËã²½Öè¼°¸ø³öÏàÓ¦µÄINCARÎļþ¡£ |
» ²ÂÄãϲ»¶
Çóµ÷¼ÁԺУÐÅÏ¢
ÒѾÓÐ4È˻ظ´
085600²ÄÁÏÓ뻯¹¤306
ÒѾÓÐ4È˻ظ´
286Çóµ÷¼Á
ÒѾÓÐ10È˻ظ´
328Çóµ÷¼Á£¬Ó¢ÓïÁù¼¶551£¬ÓпÆÑоÀú
ÒѾÓÐ9È˻ظ´
Ò»Ö¾Ô¸±±¾©»¯¹¤´óѧ070300 ѧ˶336Çóµ÷¼Á
ÒѾÓÐ4È˻ظ´
286·ÖÈ˹¤ÖÇÄÜרҵÇëÇóµ÷¼ÁÔ¸Òâ¿ç¿¼£¡
ÒѾÓÐ8È˻ظ´
×ÊÔ´Óë»·¾³ µ÷¼ÁÉêÇë(333·Ö)
ÒѾÓÐ5È˻ظ´
280Çóµ÷¼Á
ÒѾÓÐ12È˻ظ´
269ר˶Çóµ÷¼Á
ÒѾÓÐ5È˻ظ´
²ÄÁÏѧ˶301·ÖÇóµ÷¼Á
ÒѾÓÐ7È˻ظ´
» ±¾Ö÷ÌâÏà¹Ø¼ÛÖµÌùÍÆ¼ö£¬¶ÔÄúͬÑùÓаïÖú:
Spectroscopic Properties of Rare Earths in Optical Materials Ï¡ÍÁ·¢¹â²ÄÁÏ¡¡
ÒѾÓÐ56È˻ظ´
Optical properties of solids
ÒѾÓÐ320È˻ظ´
vasp¿ç½ÚµãÔËÐгö´í£¬mpiexec_node-1 (handle_stdin_input 1089)
ÒѾÓÐ5È˻ظ´
vasp5.2ÔËÐÐÖÕÖ¹
ÒѾÓÐ5È˻ظ´
the Properties of Gases and Liquids
ÒѾÓÐ55È˻ظ´
vasp5.2¼ÆËã°ëµ¼ÌåSi¹âѧÐÔÖʵÄ×ܽá
ÒѾÓÐ106È˻ظ´
¹ØÓÚͼÏñ´¦Àí·½ÃæÎÄÕÂͶoptical engineering
ÒѾÓÐ4È˻ظ´
MS¼ÆËãÑ¡Ôñoptical properties Ëã³öÀ´·ÖÎöµÃµ½µÄ¼¸¸öͼÊÇ´ú±íʲôÐÔÖÊÄØ
ÒѾÓÐ10È˻ظ´
vasp5.2 ²¢ÐбàÒëÈçºÎÐÞ¸Ämakefile
ÒѾÓÐ5È˻ظ´
No initial positions read in
ÒѾÓÐ25È˻ظ´
¡¾ÇóÖú¡¿VASP5.2 ±àÒë³ö´ímake: *** [vasp] ´íÎó 1,Çë´ó¼Ò°ïæ·ÖÎö·ÖÎö,лл
ÒѾÓÐ7È˻ظ´
¡¾ÇóÖú¡¿band structures using hybrid functionals µÄKpointsÎÊÌâ
ÒѾÓÐ18È˻ظ´
¡¾×ªÌû¡¿VASPºÍABINITÓÅȱµã±È½Ï
ÒѾÓÐ18È˻ظ´
¡¾ÇóÖú¡¿PBE0 ¼ÆËãSi¡¢GeÄÜ´ø½á¹¹
ÒѾÓÐ9È˻ظ´
dragonlong
ľ³æ (СÓÐÃûÆø)
- Ó¦Öú: 0 (Ó×¶ùÔ°)
- ½ð±Ò: 1787.4
- É¢½ð: 9
- Ìû×Ó: 144
- ÔÚÏß: 493.2Сʱ
- ³æºÅ: 68507
- ×¢²á: 2005-05-18
- רҵ: Äý¾Û̬ÎïÐÔ II £ºµç×ӽṹ
3Â¥2011-04-03 10:03:40
seek269
Ìú³æ (ÕýʽдÊÖ)
- 1STÇ¿Ìû: 1
- Ó¦Öú: 5 (Ó×¶ùÔ°)
- ½ð±Ò: 31.4
- É¢½ð: 146
- ºì»¨: 10
- Ìû×Ó: 886
- ÔÚÏß: 249.5Сʱ
- ³æºÅ: 554186
- ×¢²á: 2008-05-06
- ÐÔ±ð: GG
- רҵ: Äý¾Û̬ÎïÐÔ II £ºµç×ӽṹ
¡ï ¡ï
Сľ³æ(½ð±Ò+0.5):¸ø¸öºì°ü£¬Ð»Ð»»ØÌû½»Á÷
gzqdyouxia(½ð±Ò+1): ллÌáʾ 2011-04-01 10:16:03
Сľ³æ(½ð±Ò+0.5):¸ø¸öºì°ü£¬Ð»Ð»»ØÌû½»Á÷
gzqdyouxia(½ð±Ò+1): ллÌáʾ 2011-04-01 10:16:03
|
NBANDS´ó¸ÅÉèÖÃΪĬÈÏÖµµÄ2¡«3±¶£¬ÔÙ¼ÓÉÏLOPTICS = .TRUE. ¾Í¹»ÁË ½á¹ûÔÚoutcarÀïÃæ¿´ ¿ÉÒԵõ½½éµçº¯Êý |
2Â¥2011-04-01 09:56:51
dragonlong
ľ³æ (СÓÐÃûÆø)
- Ó¦Öú: 0 (Ó×¶ùÔ°)
- ½ð±Ò: 1787.4
- É¢½ð: 9
- Ìû×Ó: 144
- ÔÚÏß: 493.2Сʱ
- ³æºÅ: 68507
- ×¢²á: 2005-05-18
- רҵ: Äý¾Û̬ÎïÐÔ II £ºµç×ӽṹ
4Â¥2011-04-03 10:04:46
mazuju028
ľ³æ (ÕýʽдÊÖ)
- 1STÇ¿Ìû: 2
- Ó¦Öú: 30 (СѧÉú)
- ¹ó±ö: 0.141
- ½ð±Ò: 2794.4
- É¢½ð: 528
- ºì»¨: 10
- Ìû×Ó: 942
- ÔÚÏß: 419.4Сʱ
- ³æºÅ: 668835
- ×¢²á: 2008-12-05
- ÐÔ±ð: GG
- רҵ: Äý¾Û̬ÎïÐÔ II £ºµç×ӽṹ
¡ï ¡ï
Сľ³æ(½ð±Ò+0.5):¸ø¸öºì°ü£¬Ð»Ð»»ØÌû½»Á÷
zzy870720z(½ð±Ò+1): ллÌáʾ 2011-04-03 21:09:31
Сľ³æ(½ð±Ò+0.5):¸ø¸öºì°ü£¬Ð»Ð»»ØÌû½»Á÷
zzy870720z(½ð±Ò+1): ллÌáʾ 2011-04-03 21:09:31
| ÔÚMSµÄ˵Ã÷ÊéÀï¼û¹ýÓýéµç³£ÊýµÄʵ²¿ºÍÐ鲿µÃµ½ÎüÊÕÆ×ºÍ·´ÉäÆ×£¬¹«Ê½²¢²»¸´ÔÓ¡£ |

5Â¥2011-04-03 16:08:00













»Ø¸´´ËÂ¥