| 5 | 1/1 | 返回列表 |
| 查看: 1971 | 回復(fù): 9 | ||
| 當(dāng)前只顯示滿足指定條件的回帖,點(diǎn)擊這里查看本話題的所有回帖 | ||
wf900828新蟲 (初入文壇)
|
[求助]
構(gòu)型優(yōu)化時(shí)出錯(cuò)Error termination request processed by link 9999. 已有6人參與
|
|
|
輸入文件: # opt=z-matrix b3lyp/6-311+g(d) Title Card Required 0 1 H O 1 B1 C 2 B2 1 A1 C 3 B3 2 A2 1 D1 0 C 3 B4 2 A3 1 D2 0 H 4 B5 3 A4 2 D3 0 H 4 B6 3 A5 2 D4 0 H 4 B7 3 A6 2 D5 0 H 5 B8 3 A7 2 D6 0 H 5 B9 3 A8 2 D7 0 Br 5 1.98 3 A9 2 D8 0 Br 2 B11 1 A10 3 D9 0 B1 1.94169021 B2 1.21498712 B3 1.50753858 B4 1.51882021 B5 1.09705848 B6 1.08896629 B7 1.09014432 B8 1.08933284 B9 1.08561153 B11 3.38101013 A1 130.89266459 A2 121.84227621 A3 119.74998000 A4 108.15868516 A5 109.92867455 A6 112.52024619 A7 112.28889160 A8 111.05710824 A9 109.76749456 A10 4.58790207 D1 -142.29314135 D2 35.32274523 D3 98.40408473 D4 -19.46056043 D5 -143.07105094 D6 -128.68836660 D7 -3.79507659 D8 114.03403457 D9 -36.77912923 輸出文件出現(xiàn): "WOULD YOU TELL ME PLEASE, WHICH WAY I OUGHT TO WALK FROM HERE?" "THAT DEPENDS A GREAT DEAL ON WHERE YOU WANT TO GO," SAID THE CAT. "I DON'T MUCH CARE WHERE -- ", SAID ALICE. "THEN IT DOESN'T MATTER WHICH WAY YOU WALK," SAID THE CAT. -- LEWIS CARROLL Error termination request processed by link 9999. Error termination via Lnk1e in C:\G03W\l9999.exe at Wed Feb 26 19:40:16 2014. Job cpu time: 0 days 4 hours 4 minutes 29.0 seconds. File lengths (MBytes): RWF= 33 Int= 0 D2E= 0 Chk= 9 Scr= 1 |

至尊木蟲 (職業(yè)作家)
格物致知Professional

捐助貴賓 (著名寫手)
|
本帖內(nèi)容被屏蔽 |

| 最具人氣熱帖推薦 [查看全部] | 作者 | 回/看 | 最后發(fā)表 | |
|---|---|---|---|---|
|
[考研] 299求調(diào)劑 +3 | shxchem 2026-03-20 | 4/200 |
|
|---|---|---|---|---|
|
[考研] 086500 325 求調(diào)劑 +3 | 領(lǐng)帶小熊 2026-03-19 | 3/150 |
|
|
[考研] 工科材料085601 279求調(diào)劑 +7 | 困于星晨 2026-03-17 | 9/450 |
|
|
[考研] 廣西大學(xué)家禽遺傳育種課題組2026年碩士招生(接收計(jì)算機(jī)專業(yè)調(diào)劑) +3 | 123阿標(biāo) 2026-03-17 | 3/150 |
|
|
[基金申請(qǐng)]
學(xué)校已經(jīng)提交到NSFC,還能修改嗎?
40+4
|
babangida 2026-03-19 | 8/400 |
|
|
[考研] 286分人工智能專業(yè)請(qǐng)求調(diào)劑愿意跨考! +3 | lemonzzn 2026-03-17 | 4/200 |
|
|
[考研] 求調(diào)劑 +3 | 暗涌afhb 2026-03-16 | 3/150 |
|
|
[考博] 東華理工大學(xué)化材專業(yè)26屆碩士博士申請(qǐng) +8 | zlingli 2026-03-13 | 8/400 |
|
|
[考研] 一志愿西安交通大學(xué)材料工程專業(yè) 282分求調(diào)劑 +5 | 楓橋ZL 2026-03-18 | 7/350 |
|
|
[考研] 材料與化工求調(diào)劑 +7 | 為學(xué)666 2026-03-16 | 7/350 |
|
|
[考研] 材料工程專碩調(diào)劑 +5 | 204818@lcx 2026-03-17 | 6/300 |
|
|
[考研] 295求調(diào)劑 +3 | 一志愿京區(qū)211 2026-03-18 | 5/250 |
|
|
[考研] 0854可跨調(diào)劑,一作一項(xiàng)核心論文五項(xiàng)專利,省、國(guó)級(jí)證書40+數(shù)一英一287 +8 | 小李0854 2026-03-16 | 8/400 |
|
|
[考研] 一志愿西南交大,求調(diào)劑 +4 | 材化逐夢(mèng)人 2026-03-18 | 4/200 |
|
|
[考研] 材料,紡織,生物(0856、0710),化學(xué)招生啦 +3 | Eember. 2026-03-17 | 9/450 |
|
|
[考研] 材料工程專碩274一志愿211求調(diào)劑 +6 | 薛云鵬 2026-03-15 | 6/300 |
|
|
[考研] 考研調(diào)劑 +3 | 淇ya_~ 2026-03-17 | 5/250 |
|
|
[考研] 一志愿,福州大學(xué)材料專碩339分求調(diào)劑 +3 | 木子momo青爭(zhēng) 2026-03-15 | 3/150 |
|
|
[考研] 080500,材料學(xué)碩302分求調(diào)劑學(xué)校 +4 | 初識(shí)可樂(lè) 2026-03-14 | 5/250 |
|
|
[考研] 本科南京大學(xué)一志愿川大藥學(xué)327 +3 | 麥田耕者 2026-03-14 | 3/150 |
|