Towards a spectroscopically accurate set of potentials for heavy hydride laser cooling candidates: effective core potential calculations of BaH

BaH (and its isotopomers) is an attractive molecular candidate for laser cooling to ultracold temperatures and a potential precursor for the production of ultracold gases of hydrogen and deuterium. The theoretical challenge is to simulate the laser cooling cycle as reliably as possible and this paper addresses the generation of a highly accurate ab initio $^{2}\Sigma^+$ potential for such studies. The performance of various basis sets within the multi-reference configuration-interaction (MRCI) approximation with the Davidson correction (MRCI+Q)is tested and taken to the Complete Basis Set (CBS) limit. It is shown that the calculated molecular constants using a 46 electron Effective Core-Potential (ECP) and even-tempered augmented polarized core-valence basis sets (aug-pCV$n$Z-PP, n= 4 and 5) but only including three active electrons in the MRCI calculation are in excellent agreement with the available experimental values. The predicted dissociation energy De for the X$^2\Sigma^+$ state (extrapolated to the CBS limit) is 16895.12 cm$^{-1}$ (2.094 eV), which agrees within 0.1$\%$ of a revised experimental value of <16910.6 cm$^{-1}$, while the calculated re is within 0.03 pm of the experimental result.

Acerca de los j??venes de la calle en el Brasil : el caso particular de Salvador de Bah??a

Resumen basado en el que aporta la revista

Hādhā mukhtaṣar Īḍāḥ al-burhān wa-al-ḥujjah fī tafḍīl thaghr Ṭanjah al-durrah al-thamīnah al-bahīyah ṣānahā Allāh rabb al-barīyah min kull sūʼ wa-balīyah

li-Ḥ Gh L.

Hādhihi qiṣṣat al-qāḍī maʻa al-sāriq wa-mā jará baynahumā min al-muḥāwarah wa-al-āyāt al-qurʼānīyah wa-al-aḥādīth al-nabawīyah wa-al-amthāl al-ʻArabīyah ḥattá intaṣara al-liṣṣ ʻalá al-qāḍī wa-akhadha thiyābahu wa-baghlatahu wa-hiya qiṣṣah gharībah

Lithographed.

Khulāṣah-ʼi qavānīn kih az ḥuz̤ūr-i gūrnar Janral Bahādur nisbat bih ṣawbahʹjāt-i Bankālah va Bihār Awrīsah dar bāb-i har ṭūr-i maḥṣūl va tijārat

Translation into Persian.

Hādhihi risālah sanīyah wa-maqāmah bahīyah al-musammāh bi-Inbāʼ al-azkiyāʼ bi-taḥbīb al-ṭīb wa-al-nisāʼ ilá Sayyid al-anbiyāʼ / lil-ʻĀlim al-Amjad al-Mawlawī Niẓām al-Dīn Aḥmad : manuscript, 1884

Written in one column, 13 lines per page, in black and red.

Kitāb-i Bahāristān-i marḥūm Mullā Jāmī : manuscript, 1640

Title from caption.

Risālah dar bayān-i shurūṭ-i iqtidā / min taʼlīf janāb Imām al-ʻulamā Qāḍī al-Mulk Bahādur : manuscript, 1862

Title from f. 1r.

Kitāb Ghāyat al-maʼmūl fī sharḥ Zubdat al-uṣūl / al-matn li-Mawlānā al-Aqdas al-Shaykh Bahāʼ al-Dīn Khātimat al-mujtahidīn wa-al-sharḥ li-Sayyidinā al-Shaykh Muḥammad Jawād al-Kāẓimī : manuscript, 1651

Written in one column, 21 lines per pages, in black ink.

Kitāb Sihām al-iṣābah fī al-daʻawāt al-mujābah / taʼlīf al-Shaykh al-Imām al-ʻAllāmah al-Shaykh Jalāl al-Dīn al-Suyūṭī : manuscript, 1512

Copy completed on 8 Rajab 918 [September 19, 1512] in the hand of Muḥammad Abū al-Saʻūd al-Jamāl al-Anṣārī.

Hādhā al-Majmūʻ fī masāʼil al-inzālāt wa-al-khalawāt wa-al-kardār wa-mā yatbaʻu dhālika min al-naṣbah wa-al-jalsah wa-al-ḥazqah wa-min bayʻ al-waqf al-kharib ʻalá mashʹhūr madhhab al-Imām al-Aʻẓam Abī Ḥanīfah al-Nuʻmān wa-madhhab Imām Dār al-Hijrah Mālik ibn Anas

1. Risālah fī al-khulūw wa-wujūhihi ʻinda al-Miṣrīyīn wa-al-Maghāribah / li-Ismāʻīl al-Tamīmī -- 2. Suʼāl wa-fatāwá ʻanh / li-Ibrāhīm al-Riyāḥī -- 3. Asʼilah wa-ajwibah fī masāʼil al-kardār / li-Aḥmad ibn al-Khūjah -- 4. Faṣl fī ʻĀrīyat al-khulūw wa-faṣl fī al-inzālāt min Manẓūmat Laqṭ al-durar / li-Muḥammad al-Sanūsī -- 5. Jumlat Taqārīr wa-fatāwá fī al-khalawāt wa-al-inzālāt / li-Muḥammad Bayram wa-al-Shādhilī ibn Ṣāliḥ -- 6. Risālah fī Taḥqīq masʼalat al-khulūw ʻinda al-Mālikīyah / li-Aḥmad al-Fayyūmī al-Farqāwī al-Miṣrī -- 7. Risālah fī al-Kalām ʻalá bayʻ al-waqf idhā khariba wa-mā li-ahl al-madhhab min al-kalām fī dhālik / li-Yaḥyá ibn Muḥammad al-Ḥaṭṭāb.

Fawāʾid al-bahīyah dar tarjameh-yi Qawāʻid al-marʻīyah [microform]

Urdu translation of his al-Qawāʻid al-marʻīyah fī uṣūl al-ṭarīqah al-Rifāʻīyah by Muḥammad Kamāl al-Dīn al-Rifāʻī.

Hādhā Kitāb al-baḥr al-mawrūd fī al-mawāthīq wa-al-ʻuhūd /

Mode of access: Internet.

Majmūʻah [microform] : Tuḥfah-ʾi Shāhjahānī : sharḥ-i risālah-ʾi Ādāb-i Muṭālaʻah, ḥall-i tarkīb-i manṭiq maʻa munhayāt-i ʻajībah, sharḥ-i Tahẕīb bi-ḥavāshī-i jadīdah /

Microfilm.