 |
 |
 |
 |
 |
 |
||
 |
 |
 |
 |
 |
| 1 | 1/1 | 返回列表 |
| 查看: 411 | 回復(fù): 0 | ||
| 【懸賞金幣】回答本帖問(wèn)題，作者夏茉爽爽將贈(zèng)送您 15 個(gè)金幣 | ||
夏茉爽爽新蟲(chóng) (小有名氣)
|
[求助]
請(qǐng)問(wèn)下面這段話中使用的是什么計(jì)算方法？
|
|
|
文章寫(xiě)作引用時(shí)，該怎么描述這段話使用的方法？All the calculations presented in this paper were performed using theVienna ab initio simulation package (VASP) code.The instantaneouselectronic ground state was calculated by solving the Kohn–Sham equa-tion based on DFT. The periodic boundary condition was used to takecare of the periodicity of the solid. The present method used the plane-wave basis set in conjunction with the ultra-soft Vanderbilt pseudopoten-tials.The advantage of using this computationally efficient scheme isthat it permits the use of fast Fourier transform techniques. The exchangecorrelation functional was expressed within the generalized gradient ap-proximation (GGA) with the Perdew–Wang 91 functional.The Bril-louin zone sampling was restricted to the gamma point. 發(fā)自小木蟲(chóng)IOS客戶端 |
回復(fù)此樓» 猜你喜歡
什么脫膜劑可以完全清洗干凈�。�
已經(jīng)有2人回復(fù)
-
暨南大學(xué)化學(xué)與材料學(xué)院趙宇亮院士正在招博士和博后，方向?yàn)樯锊牧虾图{米醫(yī)學(xué)
已經(jīng)有1人回復(fù)
-
有機(jī)高分子材料論文潤(rùn)色/翻譯怎么收費(fèi)?
已經(jīng)有198人回復(fù)
-
可生物降解聚酯正在重塑現(xiàn)代醫(yī)療器械
已經(jīng)有0人回復(fù)
-
26屆博士申請(qǐng)
已經(jīng)有2人回復(fù)
-
PLLA 微球在生物醫(yī)學(xué)領(lǐng)域的研究與應(yīng)用
已經(jīng)有1人回復(fù)
-
PLLA 微球的材料特性與制備工藝解析
已經(jīng)有0人回復(fù)
-
醫(yī)用聚己內(nèi)酯（PCL）全解析：從兩段式降解到組織工程應(yīng)用
已經(jīng)有0人回復(fù)
-
反相硅膠如何再生？
已經(jīng)有1人回復(fù)
相關(guān)版塊跳轉(zhuǎn)
我要訂閱樓主 夏茉爽爽 的主題更新
| 1 | 1/1 | 返回列表 |
| 最具人氣熱帖推薦 [查看全部] | 作者 | 回/看 | 最后發(fā)表 | |
|---|---|---|---|---|
|
[考研]
 一志愿中南大學(xué)理學(xué)化學(xué)
+5
|
15779376950 2026-03-01 | 7/350 |
|
|---|---|---|---|---|
|
|
[基金申請(qǐng)]
成果系統(tǒng)訪問(wèn)量大，請(qǐng)15分鐘后再嘗試。由此給您造成的不便，敬請(qǐng)諒解。
+10
|
xhuama 2026-03-02 | 11/550 |
|
|
|
[考研] 0703化學(xué) 一志愿東北大學(xué) 279分求調(diào)劑 +3 | 聶樂(lè)平 2026-03-03 | 3/150 |
|
|
|
[考博] 26申博-目前4篇SCI一作 +3 | chen_2024 2026-03-02 | 3/150 |
|
|
|
[考研] 085701環(huán)境工程 求調(diào)劑 +5 | xiiiia 2026-03-04 | 5/250 |
|
|
|
[考研] 材料工程269求調(diào)劑 +7 | 白刺玫 2026-03-02 | 7/350 |
|
|
[考研] 306求調(diào)劑 +7 | 張張張張oo 2026-03-03 | 7/350 |
|
|
|
[考研] 298求調(diào)劑一志愿中海洋 +3 | lour. 2026-03-03 | 3/150 |
|
|
|
[考研] 266材料化工求調(diào)劑 +3 | 哇塞王帥 2026-03-03 | 3/150 |
|
|
|
[考研] 江蘇省農(nóng)科院招調(diào)劑1名 +5 | Qwertyuop 2026-03-01 | 5/250 |
|
|
|
[考研] 環(huán)境調(diào)劑 +5 | 柒槿levana 2026-03-01 | 5/250 |
|
|
|
[考研] 0857調(diào)劑 +6 | 一ll半 2026-02-28 | 8/400 |
|
|
|
[考研] 課題組接收材料類調(diào)劑研究生 +6 | gaoxiaoniuma 2026-02-28 | 9/450 |
|
|
|
[考研] 考研復(fù)試調(diào)劑，過(guò)國(guó)家線的同學(xué)都可報(bào)名 +7 | 黑！在干嘛 2026-02-28 | 8/400 |
|
|
|
[考研] 321求調(diào)劑一志愿東北林業(yè)大學(xué)材料與化工英二數(shù)二 +5 | 蟲(chóng)蟲(chóng)蟲(chóng)蟲(chóng)蟲(chóng)7 2026-03-01 | 9/450 |
|
|
|
[考研] 求調(diào)劑 +7 | repeatt?t 2026-02-28 | 7/350 |
|
|
|
[考研] 265分求調(diào)劑不調(diào)專業(yè)和學(xué)校有行學(xué)上就 +6 | 禮堂丁真258 2026-02-28 | 9/450 |
|
|
|
[考研] 295求調(diào)劑 +8 | 19171856320 2026-02-28 | 8/400 |
|
|
|
[考研] 材料類求調(diào)劑 +11 | wana_kiko 2026-02-28 | 14/700 |
|
|
|
[論文投稿]
Optics letters投稿被拒求助
 30+3
|
luckyry 2026-02-26 | 4/200 |
|