|
|
[ÇóÖú]
chem3d ¼ÆËã²Ëµ¥¹¦ÄÜȱ·¦
ÎÒÐÂ×°ÁËÒ»¸öchem officeÈí¼þ£¬Ê¹ÓÃÆäÖеÄchem 3d·¢ÏÖcalculations²Ëµ¥È±·¦Ò»ÏÂÄÚÈÝ£º
Compute Properties£º¼ÆËã·Ö×ӵĸ÷ÀàÐÔÖÊ
GAMESS Interface£ºGAMESS½Ó¿Ú
Gaussian Interface£ºGaussian½Ó¿Ú
Jaguar Interface£º Jaguar½Ó¿Ú
Mopac Interface£º Mopac½Ó¿Ú
Ï£Íû´óϺÃÇÄܹ»°ïÎÒ·ÖÎöÒ»ÏÂÔÒò£¬ÊDz»ÊÇȱ·¦²å¼þ£¬Èç¹ûÊǵϰ£¬ÓÐûÓкÃÐÄÈ˸øÎÒÒ»¸ö²å¼þ»òÕß´«Ò»¸öÍêÕû°æ¸øÎÒ£¬·Ç³£¸Ðл¡£ |
» ²ÂÄãϲ»¶
ÊÛSCIÒ»ÇøT0PÎÄÕ£¬ÎÒ:8.O.55.1.O54,¿ÆÄ¿È«,¿ÉÙ¤¼±
ÒѾÓÐ3È˻ظ´
ÊÛSCIÒ»ÇøÎÄÕ£¬ÎÒ:8O5.5.1.O5.4,¿ÆÄ¿È«,¿ÉÙ¤¼±
ÒѾÓÐ3È˻ظ´
ÊÛSCIÎÄÕ£¬ÎÒ:8O.5.5.1O.54,¿ÆÄ¿È«,¿ÉÊ®¼±
ÒѾÓÐ3È˻ظ´
ÊÛSCIÒ»ÇøT0PÎÄÕ£¬ÎÒ:8.O.55.1.O54,¿ÆÄ¿È«,¿ÉÙ¤¼±
ÒѾÓÐ4È˻ظ´
ÊÛSCIÒ»ÇøT0PÎÄÕ£¬ÎÒ:8O.55.1.O.5.4,¿ÆÄ¿ÆëÈ«,¿É+¼±
ÒѾÓÐ5È˻ظ´
ÊÛÒ»ÇøSCIÎÄÕÂT0P£¬ÎÒ:8O.551.O54,¿ÆÄ¿È«,¿ÉÊ®¼±
ÒѾÓÐ4È˻ظ´
ÊÛSCIÎÄÕ£¬ÎÒ:8O.5.5.1O.54,¿ÆÄ¿È«,¿ÉÊ®¼±
ÒѾÓÐ6È˻ظ´
ÊÛSCIÒ»ÇøT0PÎÄÕ£¬ÎÒ:8.O.55.1.O.5.4,¿ÆÄ¿È«,¿É+¼±
ÒѾÓÐ5È˻ظ´
ÊÛSCIÒ»ÇøÎÄÕ£¬ÎÒ:8.O.55.1.O.54,¿ÆÄ¿ÆëÈ«,¿ÉÙ¤¼±
ÒѾÓÐ8È˻ظ´
ÊÛSCIÒ»ÇøT0PÎÄÕ£¬ÎÒ:8.O55.1.O.54,¿ÆÄ¿È«,¿ÉÊ®¼±
ÒѾÓÐ6È˻ظ´
» ±¾Ö÷ÌâÏà¹Ø¼ÛÖµÌùÍÆ¼ö£¬¶ÔÄúͬÑùÓаïÖú:
|