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Studies of deuterated isotopologues of complex organic molecules can provide important constraints on their origin in star formation regions. In particular, the abundances of deuterated species are very sensitive to the physical conditions in the environment where they form. Because the temperatures in star formation regions are low, these isotopologues are enhanced to significant levels, which enables the detection of multiply deuterated species. However, for complex organic species, so far only the multiply deuterated variants of methanol and methyl cyanide have been reported. The aim of this paper is to initiate the characterisation of multiply deuterated variants of complex organic species with the first detection of doubly deuterated methyl formate, CHD2OCHO. We use ALMA observations from the Protostellar Interferometric Line Survey (PILS) of the protostellar binary IRAS 16293-2422 in the spectral range of 329.1 GHz to 362.9 GHz. Spectra towards each of the two protostars are extracted and analysed using a local thermal equilibrium model in order to derive the abundances of methyl formate and its deuterated variants. We report the first detection of doubly deuterated methyl formate CHD2OCHO in the ISM. The D-to-H ratio (D/H ratio) of CHD2OCHO is found to be 2-3 times higher than the D/H ratio of CH2DOCHO for both sources, similar to the results for formaldehyde from the same dataset. The observations are compared to a gas-grain chemical network coupled to a dynamical physical model, tracing the evolution of a molecular cloud until the end of the Class 0 protostellar stage. The overall D/H ratio enhancements found in the observations are of about the same magnitude as the predictions from the model for the early stages of Class 0 protostars. However, that the D/H ratio of CHD2OCHO is higher than that of CH2DOCHO is still not predicted by the model. This suggests that a mechanism enhances the D/H ratio of singly and doubly deuterated methyl formate that is not in

Context. The majority of stars form in binary or higher order systems. The evolution of each protostar in a multiple system may start at different times and may progress differently. The Class 0 protostellar system IRAS 16293-2422 contains two protostars, A and B, separated by similar to 600 au and embedded in a single, 10(4) au scale envelope. Their relative evolutionary stages have been debated. Aims. We aim to study the relation and interplay between the two protostars A and B at spatial scales of 60 au up to similar to 10(3) au. Methods. We selected molecular gas line transitions of the species CO, H2CO, HCN, CS, SiO, and C2H from the ALMA-PILS spectral imaging survey (329-363 GHz) and used them as tracers of kinematics, density, and temperature in the IRAS 16293-2422 system. The angular resolution of the PILS data set allows us to study these quantities at a resolution of 0.5 '' (60 au at the distance of the source). Results. Line-of-sight velocity maps of both optically thick and optically thin molecular lines reveal: (i) new manifestations of previously known outflows emanating from protostar A; (ii) a kinematically quiescent bridge of dust and gas spanning between the two protostars, with an inferred density between 4 x 10(4) cm(-3) and similar to 3 x 10(7) cm(-3); and (iii) a separate, straight filament seemingly connected to protostar B seen only in C2H, with a flat kinematic signature. Signs of various outflows, all emanating from source A, are evidence of high-density and warmer gas; none of them coincide spatially and kinematically with the bridge. Conclusions. We hypothesize that the bridge arc is a remnant of filamentary substructure in the protostellar envelope material from which protostellar sources A and B have formed. One particular morphological structure appears to be due to outflowing gas impacting the quiescent bridge material. The continuing lack of clear outflow signatures unambiguously associated to protostar B and the vertically extended

Studies of deuterated isotopologues of complex organic molecules can provide important constraints on their origin in star formation regions. In particular, the abundances of deuterated species are very sensitive to the physical conditions in the environment where they form. Because the temperatures in star formation regions are low, these isotopologues are enhanced to significant levels, which enables the detection of multiply deuterated species. However, for complex organic species, so far only the multiply deuterated variants of methanol and methyl cyanide have been reported. The aim of this paper is to initiate the characterisation of multiply deuterated variants of complex organic species with the first detection of doubly deuterated methyl formate, CHD2OCHO. We use ALMA observations from the Protostellar Interferometric Line Survey (PILS) of the protostellar binary IRAS 16293-2422 in the spectral range of 329.1 GHz to 362.9 GHz. Spectra towards each of the two protostars are extracted and analysed using a local thermal equilibrium model in order to derive the abundances of methyl formate and its deuterated variants. We report the first detection of doubly deuterated methyl formate CHD2OCHO in the ISM. The D-to-H ratio (D/H ratio) of CHD2OCHO is found to be 2-3 times higher than the D/H ratio of CH2DOCHO for both sources, similar to the results for formaldehyde from the same dataset. The observations are compared to a gas-grain chemical network coupled to a dynamical physical model, tracing the evolution of a molecular cloud until the end of the Class 0 protostellar stage. The overall D/H ratio enhancements found in the observations are of about the same magnitude as the predictions from the model for the early stages of Class 0 protostars. However, that the D/H ratio of CHD2OCHO is higher than that of CH2DOCHO is still not predicted by the model. This suggests that a mechanism enhances the D/H ratio of singly and doubly deuterated methyl formate that is not in

Context. The majority of stars form in binary or higher order systems. The evolution of each protostar in a multiple system may start at different times and may progress differently. The Class 0 protostellar system IRAS 16293-2422 contains two protostars, A and B, separated by similar to 600 au and embedded in a single, 10(4) au scale envelope. Their relative evolutionary stages have been debated. Aims. We aim to study the relation and interplay between the two protostars A and B at spatial scales of 60 au up to similar to 10(3) au. Methods. We selected molecular gas line transitions of the species CO, H2CO, HCN, CS, SiO, and C2H from the ALMA-PILS spectral imaging survey (329-363 GHz) and used them as tracers of kinematics, density, and temperature in the IRAS 16293-2422 system. The angular resolution of the PILS data set allows us to study these quantities at a resolution of 0.5 '' (60 au at the distance of the source). Results. Line-of-sight velocity maps of both optically thick and optically thin molecular lines reveal: (i) new manifestations of previously known outflows emanating from protostar A; (ii) a kinematically quiescent bridge of dust and gas spanning between the two protostars, with an inferred density between 4 x 10(4) cm(-3) and similar to 3 x 10(7) cm(-3); and (iii) a separate, straight filament seemingly connected to protostar B seen only in C2H, with a flat kinematic signature. Signs of various outflows, all emanating from source A, are evidence of high-density and warmer gas; none of them coincide spatially and kinematically with the bridge. Conclusions. We hypothesize that the bridge arc is a remnant of filamentary substructure in the protostellar envelope material from which protostellar sources A and B have formed. One particular morphological structure appears to be due to outflowing gas impacting the quiescent bridge material. The continuing lack of clear outflow signatures unambiguously associated to protostar B and the vertically extended

Context. The Class 0 protostellar binary IRAS 16293-2422 is an interesting target for (sub) millimeter observations due to, both, the rich chemistry toward the two main components of the binary and its complex morphology. Its proximity to Earth allows the study of its physical and chemical structure on solar system scales using high angular resolution observations. Such data reveal a complex morphology that cannot be accounted for in traditional, spherical 1D models of the envelope. Aims. The purpose of this paper is to study the environment of the two components of the binary through 3D radiative transfer modeling and to compare with data from the Atacama Large Millimeter/submillimeter Array. Such comparisons can be used to constrain the protoplanetary disk structures, the luminosities of the two components of the binary and the chemistry of simple species. Methods. We present (CO)-C-13, (CO)-O-17 and (CO)-O-18 J = 3-2 observations from the ALMA Protostellar Interferometric Line Survey (PILS), together with a qualitative study of the dust and gas density distribution of IRAS 16293-2422. A 3D dust and gas model including disks and a dust filament between the two protostars is constructed which qualitatively reproduces the dust continuum and gas line emission. Results. Radiative transfer modeling in our sampled parameter space suggests that, while the disk around source A could not be constrained, the disk around source B has to be vertically extended. This puffed-up structure can be obtained with both a protoplanetary disk model with an unexpectedly high scale-height and with the density solution from an infalling, rotating collapse. Combined constraints on our 3D model, from observed dust continuum and CO isotopologue emission between the sources, corroborate that source A should be at least six times more luminous than source B. We also demonstrate that the volume of high-temperature regions where complex organic molecules arise is sensitive to whether or not the

Context. Complex organic molecules are readily detected in the inner regions of the gaseous envelopes of forming protostars. Their detection is crucial to understanding the chemical evolution of the Universe and exploring the link between the early stages of star formation and the formation of solar system bodies, where complex organic molecules have been found in abundance. In particular, molecules that contain nitrogen are interesting due to the role nitrogen plays in the development of life and the compact scales such molecules have been found to trace around forming protostars. Aims. The goal of this work is to determine the inventory of one family of nitrogen-bearing organic molecules, complex nitriles (molecules with a -C N functional group) towards two hot corino sources in the low-mass protostellar binary IRAS 16293-2422. This work explores the abundance differences between the two sources, the isotopic ratios, and the spatial extent derived from molecules containing the nitrile functional group. Methods. Using data from the Protostellar Interferometric Line Survey (PILS) obtained with ALMA, we determine abundances and excitation temperatures for the detected nitriles. We also present a new method for determining the spatial structure of sources with high line density and large velocity gradients-Velocity-corrected INtegrated emission (VINE) maps. Results. We detect methyl cyanide (CH3CN) as well as five of its isotopologues, including CHD2CN, which is the first detection in the interstellar medium (ISM). We also detect ethyl cyanide (C2H5CN), vinyl cyanide (C2H3CN), and cyanoacetylene (HC3N). We find that abundances are similar between IRAS 16293A and IRAS 16293B on small scales except for vinyl cyanide which is only detected towards the latter source. This suggests an important difference between the sources either in their evolutionary stage or warm-up timescales. We also detect a spatially double-peaked emission for the first time in molecular emission i

Context. Hydroxylamine (NH2OH) and methylamine (CH3NH2) have both been suggested as precursors to the formation of amino acids and are therefore, of interest to prebiotic chemistry. Their presence in interstellar space and formation mechanisms, however, are not well established. Aims. We aim to detect both amines and their potential precursor molecules NO, N2O, and CH2NH towards the low-mass protostellar binary IRAS 16293-2422, in order to investigate their presence and constrain their interstellar formation mechanisms around a young Sun-like protostar. Methods. ALMA observations from the unbiased, high-angular resolution and sensitivity Protostellar Interferometric Line Survey (PILS) are used. Spectral transitions of the molecules under investigation are searched for with the CASSIS line analysis software. Results. CH2NH and N2O are detected for the first time, towards a low-mass source, the latter molecule through confirmation with the single-dish TIMASSS survey. NO is also detected. CH3NH2 and NH2OH are not detected and stringent upper limit column densities are determined. Conclusions. The non-detection of CH3NH2 and NH2OH limits the importance of formation routes to amino acids involving these species. The detection of CH2NH makes amino acid formation routes starting from this molecule plausible. The low abundances of CH2NH and CH3NH2 compared to Sgr B2 indicate that different physical conditions influence their formation in low- and high-mass sources.

Context. Methyl isocyanide (CH3NC) is the isocyanide with the largest number of atoms confirmed in the interstellar medium (ISM), but it is not an abundant molecule, having only been detected towards a handful of objects. Conversely, its isomer, methyl cyanide (CH3CN), is one of the most abundant complex organic molecules detected in the ISM, with detections in a variety of low-and high-mass sources. Aims. The aims of this work are to determine the abundances of methyl isocyanide in the solar-type protostellar binary IRAS 16293-2422 and to understand the stark abundance differences observed between methyl isocyanide and methyl cyanide in the ISM. Methods. We use Atacama Large Millimeter/submillimeter Array (ALMA) observations from the Protostellar Interferometric Line Survey (PILS) to search for methyl isocyanide and compare its abundance with that of its isomer methyl cyanide. We use a new line catalogue from the Cologne Database for Molecular Spectroscopy (CDMS) to identify methyl isocyanide lines. We also model the chemistry with an updated version of the three-phase chemical kinetics model MAGICKAL, presenting the first chemical modelling of methyl isocyanide to date. Results. We detect methyl isocyanide for the first time in a solar-type protostar, IRAS 16293-2422 B, and present upper limits for its companion protostar, IRAS 16293-2422 A. Methyl isocyanide is found to be at least 20 times more abundant in source B compared to source A, with a CH3CN/CH3NC abundance ratio of 200 in IRAS 16293-2422 B and >5517 in IRAS 16293-2422 A. We also present the results of a chemical model of methyl isocyanide chemistry in both sources, and discuss the implications for methyl isocyanide formation mechanisms and the relative evolutionary stages of both sources. The chemical modelling is unable to match the observed CH3CN/CH3NC abundance ratio towards the B source at densities representative of that source. The modelling, however, is consistent with the upper limits for the A

Context. The Class 0 protostellar binary IRAS 16293-2422 is an interesting target for (sub) millimeter observations due to, both, the rich chemistry toward the two main components of the binary and its complex morphology. Its proximity to Earth allows the study of its physical and chemical structure on solar system scales using high angular resolution observations. Such data reveal a complex morphology that cannot be accounted for in traditional, spherical 1D models of the envelope. Aims. The purpose of this paper is to study the environment of the two components of the binary through 3D radiative transfer modeling and to compare with data from the Atacama Large Millimeter/submillimeter Array. Such comparisons can be used to constrain the protoplanetary disk structures, the luminosities of the two components of the binary and the chemistry of simple species. Methods. We present (CO)-C-13, (CO)-O-17 and (CO)-O-18 J = 3-2 observations from the ALMA Protostellar Interferometric Line Survey (PILS), together with a qualitative study of the dust and gas density distribution of IRAS 16293-2422. A 3D dust and gas model including disks and a dust filament between the two protostars is constructed which qualitatively reproduces the dust continuum and gas line emission. Results. Radiative transfer modeling in our sampled parameter space suggests that, while the disk around source A could not be constrained, the disk around source B has to be vertically extended. This puffed-up structure can be obtained with both a protoplanetary disk model with an unexpectedly high scale-height and with the density solution from an infalling, rotating collapse. Combined constraints on our 3D model, from observed dust continuum and CO isotopologue emission between the sources, corroborate that source A should be at least six times more luminous than source B. We also demonstrate that the volume of high-temperature regions where complex organic molecules arise is sensitive to whether or not the

Context. Complex organic molecules are readily detected in the inner regions of the gaseous envelopes of forming protostars. Their detection is crucial to understanding the chemical evolution of the Universe and exploring the link between the early stages of star formation and the formation of solar system bodies, where complex organic molecules have been found in abundance. In particular, molecules that contain nitrogen are interesting due to the role nitrogen plays in the development of life and the compact scales such molecules have been found to trace around forming protostars. Aims. The goal of this work is to determine the inventory of one family of nitrogen-bearing organic molecules, complex nitriles (molecules with a -C N functional group) towards two hot corino sources in the low-mass protostellar binary IRAS 16293-2422. This work explores the abundance differences between the two sources, the isotopic ratios, and the spatial extent derived from molecules containing the nitrile functional group. Methods. Using data from the Protostellar Interferometric Line Survey (PILS) obtained with ALMA, we determine abundances and excitation temperatures for the detected nitriles. We also present a new method for determining the spatial structure of sources with high line density and large velocity gradients-Velocity-corrected INtegrated emission (VINE) maps. Results. We detect methyl cyanide (CH3CN) as well as five of its isotopologues, including CHD2CN, which is the first detection in the interstellar medium (ISM). We also detect ethyl cyanide (C2H5CN), vinyl cyanide (C2H3CN), and cyanoacetylene (HC3N). We find that abundances are similar between IRAS 16293A and IRAS 16293B on small scales except for vinyl cyanide which is only detected towards the latter source. This suggests an important difference between the sources either in their evolutionary stage or warm-up timescales. We also detect a spatially double-peaked emission for the first time in molecular emission i

Context. Methyl isocyanide (CH3NC) is the isocyanide with the largest number of atoms confirmed in the interstellar medium (ISM), but it is not an abundant molecule, having only been detected towards a handful of objects. Conversely, its isomer, methyl cyanide (CH3CN), is one of the most abundant complex organic molecules detected in the ISM, with detections in a variety of low-and high-mass sources. Aims. The aims of this work are to determine the abundances of methyl isocyanide in the solar-type protostellar binary IRAS 16293-2422 and to understand the stark abundance differences observed between methyl isocyanide and methyl cyanide in the ISM. Methods. We use Atacama Large Millimeter/submillimeter Array (ALMA) observations from the Protostellar Interferometric Line Survey (PILS) to search for methyl isocyanide and compare its abundance with that of its isomer methyl cyanide. We use a new line catalogue from the Cologne Database for Molecular Spectroscopy (CDMS) to identify methyl isocyanide lines. We also model the chemistry with an updated version of the three-phase chemical kinetics model MAGICKAL, presenting the first chemical modelling of methyl isocyanide to date. Results. We detect methyl isocyanide for the first time in a solar-type protostar, IRAS 16293-2422 B, and present upper limits for its companion protostar, IRAS 16293-2422 A. Methyl isocyanide is found to be at least 20 times more abundant in source B compared to source A, with a CH3CN/CH3NC abundance ratio of 200 in IRAS 16293-2422 B and >5517 in IRAS 16293-2422 A. We also present the results of a chemical model of methyl isocyanide chemistry in both sources, and discuss the implications for methyl isocyanide formation mechanisms and the relative evolutionary stages of both sources. The chemical modelling is unable to match the observed CH3CN/CH3NC abundance ratio towards the B source at densities representative of that source. The modelling, however, is consistent with the upper limits for the A

Context. Hydroxylamine (NH2OH) and methylamine (CH3NH2) have both been suggested as precursors to the formation of amino acids and are therefore, of interest to prebiotic chemistry. Their presence in interstellar space and formation mechanisms, however, are not well established. Aims. We aim to detect both amines and their potential precursor molecules NO, N2O, and CH2NH towards the low-mass protostellar binary IRAS 16293-2422, in order to investigate their presence and constrain their interstellar formation mechanisms around a young Sun-like protostar. Methods. ALMA observations from the unbiased, high-angular resolution and sensitivity Protostellar Interferometric Line Survey (PILS) are used. Spectral transitions of the molecules under investigation are searched for with the CASSIS line analysis software. Results. CH2NH and N2O are detected for the first time, towards a low-mass source, the latter molecule through confirmation with the single-dish TIMASSS survey. NO is also detected. CH3NH2 and NH2OH are not detected and stringent upper limit column densities are determined. Conclusions. The non-detection of CH3NH2 and NH2OH limits the importance of formation routes to amino acids involving these species. The detection of CH2NH makes amino acid formation routes starting from this molecule plausible. The low abundances of CH2NH and CH3NH2 compared to Sgr B2 indicate that different physical conditions influence their formation in low- and high-mass sources.

In molecular outflows from forming low-mass protostars, most oxygen is expected to be locked up in water. However, Herschel observations have shown that typically an order of magnitude or more of the oxygen is still unaccounted for. To test if the oxygen is instead in atomic form, SOFIA-GREAT observed the R1 position of the bright molecular outflow from NGC 1333-IRAS4A. The [O I] 63 mu m line is detected and spectrally resolved. From an intensity peak at + 15 kms(-1), the intensity decreases until + 50 kms-1. The profile is similar to that of high-velocity (HV) H2O and CO 16-15, the latter observed simultaneously with [O I]. A radiative transfer analysis suggests that similar to 15% of the oxygen is in atomic form toward this shock position. The CO abundance is inferred to be similar to 10(-4) by a similar analysis, suggesting that this is the dominant oxygen carrier in the HV component. These results demonstrate that a large portion of the observed [O I] emission is part of the outflow. Further observations are required to verify whether this is a general trend.

Context. Protostellar jets and outflows are key features of the star-formation process, and primary processes of the feedback of young stars on the interstellar medium. Understanding the underlying shocks is necessary to explain how jet and outflow systems are launched, and to quantify their chemical and energetic impacts on the surrounding medium. Aims. We performed a high-spectral resolution study of the [OI](63 mu m) emission in the outflow of the intermediate-mass Class 0 protostar Cep E-mm. The goal is to determine the structure of the outflow, to constrain the chemical conditions in the various components, and to understand the nature of the underlying shocks, thus probing the origin of the mass-loss phenomenon. Methods. We present observations of the O I P-3(1) -> P-3(2), OH between (2)Pi(1/2) J = 3/2 and J = 1/2 at 1837.8 GHz, and CO (16-15) lines with the GREAT receiver onboard SOFIA towards three positions in the Cep E protostellar outflow: Cep E-mm (the driving protostar), Cep E-BI (in the southern lobe), and Cep E-BII (the terminal position in the southern lobe). Results. The CO (16-15) line is detected at all three positions. The [OI](63 mu m) line is detected in Cep E-BI and BII, whereas the OH line is not detected. In Cep E-BII, we identify three kinematical components in O I and CO. These were already detected in CO transitions and relate to spatial components: the jet, the HH377 terminal bow-shock, and the outflow cavity. We measure line temperature and line integrated intensity ratios for all components. The O I column density is higher in the outflow cavity than in the jet, which itself is higher than in the terminal shock. The terminal shock is the region where the abundance ratio of O I to CO is the lowest (about 0.2), whereas the jet component is atomic (N(O I) /N(CO) similar to 2.7). In the jet, we compare the [OI](63 mu m) observations with shock models that successfully fit the integrated intensity of 10 CO lines. We find that these models m

In molecular outflows from forming low-mass protostars, most oxygen is expected to be locked up in water. However, Herschel observations have shown that typically an order of magnitude or more of the oxygen is still unaccounted for. To test if the oxygen is instead in atomic form, SOFIA-GREAT observed the R1 position of the bright molecular outflow from NGC 1333-IRAS4A. The [O I] 63 mu m line is detected and spectrally resolved. From an intensity peak at + 15 kms(-1), the intensity decreases until + 50 kms-1. The profile is similar to that of high-velocity (HV) H2O and CO 16-15, the latter observed simultaneously with [O I]. A radiative transfer analysis suggests that similar to 15% of the oxygen is in atomic form toward this shock position. The CO abundance is inferred to be similar to 10(-4) by a similar analysis, suggesting that this is the dominant oxygen carrier in the HV component. These results demonstrate that a large portion of the observed [O I] emission is part of the outflow. Further observations are required to verify whether this is a general trend.

Context. Protostellar jets and outflows are key features of the star-formation process, and primary processes of the feedback of young stars on the interstellar medium. Understanding the underlying shocks is necessary to explain how jet and outflow systems are launched, and to quantify their chemical and energetic impacts on the surrounding medium. Aims. We performed a high-spectral resolution study of the [OI](63 mu m) emission in the outflow of the intermediate-mass Class 0 protostar Cep E-mm. The goal is to determine the structure of the outflow, to constrain the chemical conditions in the various components, and to understand the nature of the underlying shocks, thus probing the origin of the mass-loss phenomenon. Methods. We present observations of the O I P-3(1) -> P-3(2), OH between (2)Pi(1/2) J = 3/2 and J = 1/2 at 1837.8 GHz, and CO (16-15) lines with the GREAT receiver onboard SOFIA towards three positions in the Cep E protostellar outflow: Cep E-mm (the driving protostar), Cep E-BI (in the southern lobe), and Cep E-BII (the terminal position in the southern lobe). Results. The CO (16-15) line is detected at all three positions. The [OI](63 mu m) line is detected in Cep E-BI and BII, whereas the OH line is not detected. In Cep E-BII, we identify three kinematical components in O I and CO. These were already detected in CO transitions and relate to spatial components: the jet, the HH377 terminal bow-shock, and the outflow cavity. We measure line temperature and line integrated intensity ratios for all components. The O I column density is higher in the outflow cavity than in the jet, which itself is higher than in the terminal shock. The terminal shock is the region where the abundance ratio of O I to CO is the lowest (about 0.2), whereas the jet component is atomic (N(O I) /N(CO) similar to 2.7). In the jet, we compare the [OI](63 mu m) observations with shock models that successfully fit the integrated intensity of 10 CO lines. We find that these models m

Context. OH is a key molecule in H2O chemistry, a valuable tool for probing physical conditions, and an important contributor to the cooling of shock regions around high-mass protostars. OH participates in the re -distribution of energy from the protostar towards the surrounding Interstellar Medium. Aims. Our aim is to assess the origin of the OH emission from the Cepheus A massive star-forming region and to constrain the physical conditions prevailing in the emitting gas. We thus want to probe the processes at work during the formation of massive stars. Methods. We present spectrally resolved observations of OH towards the protostellar outflows region of Cepheus A with the GREAT spectrometer onboard the Stratospheric Observatory for Infrared Astronomy (SOFIA) telescope. Three triplets were observed at 1834.7 GHz, 1837.8 GHz, and 2514.3 GHz (163.4 pm, 163.1 pm between the (II1/2)-I-2 J = 3/2 and J = 1/2 states, and 119.2 pm, a ground transition between the (2)Pi(3/2) J = 5/2 and J = 3/2 states), at angular resolutions of 16.'3, 16.'3, and 11'.'9, respectively. We also present the CO (16-15) spectrum at the same position. We compared the integrated intensities in the redshifted wings to the results of shock models. Results. The two OH triplets near 163 pm are detected in emission, but with blending hyperfine structure unresolved. Their profiles and that of CO (16-15) can be fitted by a combination of two or three Gaussians. The observed 119.2 mu m triplet is seen in absorption, since its blending hyperfine structure is unresolved, but with three line-of-sight components and a blueshifted emission wing consistent with that of the other lines. The OH line wings are similar to those of CO, suggesting that they emanate from the same shocked structure. Conclusions. Under this common origin assumption, the observations fall within the model predictions and within the range of use of our model only if we consider that four shock structures are caught in our beam. Overall, o

Context. OH is a key molecule in H2O chemistry, a valuable tool for probing physical conditions, and an important contributor to the cooling of shock regions around high-mass protostars. OH participates in the re -distribution of energy from the protostar towards the surrounding Interstellar Medium. Aims. Our aim is to assess the origin of the OH emission from the Cepheus A massive star-forming region and to constrain the physical conditions prevailing in the emitting gas. We thus want to probe the processes at work during the formation of massive stars. Methods. We present spectrally resolved observations of OH towards the protostellar outflows region of Cepheus A with the GREAT spectrometer onboard the Stratospheric Observatory for Infrared Astronomy (SOFIA) telescope. Three triplets were observed at 1834.7 GHz, 1837.8 GHz, and 2514.3 GHz (163.4 pm, 163.1 pm between the (II1/2)-I-2 J = 3/2 and J = 1/2 states, and 119.2 pm, a ground transition between the (2)Pi(3/2) J = 5/2 and J = 3/2 states), at angular resolutions of 16.'3, 16.'3, and 11'.'9, respectively. We also present the CO (16-15) spectrum at the same position. We compared the integrated intensities in the redshifted wings to the results of shock models. Results. The two OH triplets near 163 pm are detected in emission, but with blending hyperfine structure unresolved. Their profiles and that of CO (16-15) can be fitted by a combination of two or three Gaussians. The observed 119.2 mu m triplet is seen in absorption, since its blending hyperfine structure is unresolved, but with three line-of-sight components and a blueshifted emission wing consistent with that of the other lines. The OH line wings are similar to those of CO, suggesting that they emanate from the same shocked structure. Conclusions. Under this common origin assumption, the observations fall within the model predictions and within the range of use of our model only if we consider that four shock structures are caught in our beam. Overall, o

Context. During the formation of a star, material is ejected along powerful jets that impact the ambient material. This outflow regulates star formation by e.g. inducing turbulence and heating the surrounding gas. Understanding the associated shocks is therefore essential to the study of star formation. Aims. We present comparisons of shock models with CO, H-2, and SiO observations in a pure shock position in the BHR71 bipolar outflow. These comparisons provide an insight into the shock and pre-shock characteristics, and allow us to understand the energetic and chemical feedback of star formation on Galactic scales. Methods. New CO (J(up) = 16, 11, 7, 6, 4, 3) observations from the shocked regions with the SOFIA and APEX telescopes are presented and combined with earlier H-2 and SiO data (from the Spitzer and APEX telescopes). The integrated intensities are compared to a grid of models that were obtained from a magneto-hydrodynamical shock code, which calculates the dynamical and chemical structure of these regions combined with a radiative transfer module based on the large velocity gradient approximation. Results. The CO emission leads us to update the conclusions of our previous shock analysis: pre-shock densities of 10(4) cm(-3) and shock velocities around 20-25 km s(-1) are still constrained, but older ages are inferred (similar to 4000 years). Conclusions. We evaluate the contribution of shocks to the excitation of CO around forming stars. The SiO observations are compatible with a scenario where less than 4% of the pre-shock SiO belongs to the grain mantles. We infer outflow parameters: a mass of 1.8 x 10(-2) M-circle dot was measured in our beam, in which a momentum of 0.4 M-circle dot km s(-1) is dissipated, corresponding to an energy of 4.2 x 10(43) erg. We analyse the energetics of the outflow species by species. Comparing our results with previous studies highlights their dependence on the method: H-2 observations only are not sufficient to evaluate the

Context. During the formation of a star, material is ejected along powerful jets that impact the ambient material. This outflow regulates star formation by e.g. inducing turbulence and heating the surrounding gas. Understanding the associated shocks is therefore essential to the study of star formation. Aims. We present comparisons of shock models with CO, H-2, and SiO observations in a pure shock position in the BHR71 bipolar outflow. These comparisons provide an insight into the shock and pre-shock characteristics, and allow us to understand the energetic and chemical feedback of star formation on Galactic scales. Methods. New CO (J(up) = 16, 11, 7, 6, 4, 3) observations from the shocked regions with the SOFIA and APEX telescopes are presented and combined with earlier H-2 and SiO data (from the Spitzer and APEX telescopes). The integrated intensities are compared to a grid of models that were obtained from a magneto-hydrodynamical shock code, which calculates the dynamical and chemical structure of these regions combined with a radiative transfer module based on the large velocity gradient approximation. Results. The CO emission leads us to update the conclusions of our previous shock analysis: pre-shock densities of 10(4) cm(-3) and shock velocities around 20-25 km s(-1) are still constrained, but older ages are inferred (similar to 4000 years). Conclusions. We evaluate the contribution of shocks to the excitation of CO around forming stars. The SiO observations are compatible with a scenario where less than 4% of the pre-shock SiO belongs to the grain mantles. We infer outflow parameters: a mass of 1.8 x 10(-2) M-circle dot was measured in our beam, in which a momentum of 0.4 M-circle dot km s(-1) is dissipated, corresponding to an energy of 4.2 x 10(43) erg. We analyse the energetics of the outflow species by species. Comparing our results with previous studies highlights their dependence on the method: H-2 observations only are not sufficient to evaluate the

Context. During the formation of a star, material is ejected along powerful jets that impact the ambient material. This outflow regulates star formation by e.g. inducing turbulence and heating the surrounding gas. Understanding the associated shocks is therefore essential to the study of star formation. Aims. We present comparisons of shock models with CO, H-2, and SiO observations in a pure shock position in the BHR71 bipolar outflow. These comparisons provide an insight into the shock and pre-shock characteristics, and allow us to understand the energetic and chemical feedback of star formation on Galactic scales. Methods. New CO (J(up) = 16, 11, 7, 6, 4, 3) observations from the shocked regions with the SOFIA and APEX telescopes are presented and combined with earlier H-2 and SiO data (from the Spitzer and APEX telescopes). The integrated intensities are compared to a grid of models that were obtained from a magneto-hydrodynamical shock code, which calculates the dynamical and chemical structure of these regions combined with a radiative transfer module based on the large velocity gradient approximation. Results. The CO emission leads us to update the conclusions of our previous shock analysis: pre-shock densities of 10(4) cm(-3) and shock velocities around 20-25 km s(-1) are still constrained, but older ages are inferred (similar to 4000 years). Conclusions. We evaluate the contribution of shocks to the excitation of CO around forming stars. The SiO observations are compatible with a scenario where less than 4% of the pre-shock SiO belongs to the grain mantles. We infer outflow parameters: a mass of 1.8 x 10(-2) M-circle dot was measured in our beam, in which a momentum of 0.4 M-circle dot km s(-1) is dissipated, corresponding to an energy of 4.2 x 10(43) erg. We analyse the energetics of the outflow species by species. Comparing our results with previous studies highlights their dependence on the method: H-2 observations only are not sufficient to evaluate the

Context. During the formation of a star, material is ejected along powerful jets that impact the ambient material. This outflow regulates star formation by e.g. inducing turbulence and heating the surrounding gas. Understanding the associated shocks is therefore essential to the study of star formation. Aims. We present comparisons of shock models with CO, H-2, and SiO observations in a pure shock position in the BHR71 bipolar outflow. These comparisons provide an insight into the shock and pre-shock characteristics, and allow us to understand the energetic and chemical feedback of star formation on Galactic scales. Methods. New CO (J(up) = 16, 11, 7, 6, 4, 3) observations from the shocked regions with the SOFIA and APEX telescopes are presented and combined with earlier H-2 and SiO data (from the Spitzer and APEX telescopes). The integrated intensities are compared to a grid of models that were obtained from a magneto-hydrodynamical shock code, which calculates the dynamical and chemical structure of these regions combined with a radiative transfer module based on the large velocity gradient approximation. Results. The CO emission leads us to update the conclusions of our previous shock analysis: pre-shock densities of 10(4) cm(-3) and shock velocities around 20-25 km s(-1) are still constrained, but older ages are inferred (similar to 4000 years). Conclusions. We evaluate the contribution of shocks to the excitation of CO around forming stars. The SiO observations are compatible with a scenario where less than 4% of the pre-shock SiO belongs to the grain mantles. We infer outflow parameters: a mass of 1.8 x 10(-2) M-circle dot was measured in our beam, in which a momentum of 0.4 M-circle dot km s(-1) is dissipated, corresponding to an energy of 4.2 x 10(43) erg. We analyse the energetics of the outflow species by species. Comparing our results with previous studies highlights their dependence on the method: H-2 observations only are not sufficient to evaluate the

Early results from the Herschel Space Observatory revealed the water cation H2O+ to be an abundant ingredient of the interstellar medium. Here we present new observations of the H2O and H2O+ lines at 1113.3 and 1115.2 GHz using the Herschel Space Observatory toward a sample of high-mass star-forming regions to observationally study the relation between H2O and H2O+. Nine out of ten sources show absorption from H2O+ in a range of environments: the molecular clumps surrounding the forming and newly formed massive stars, bright high-velocity outflows associated with the massive protostars, and unrelated low-density clouds along the line of sight. Column densities per velocity component of H2O+ are found in the range of 10(12) to a few 10(13) cm(-2). The highest N(H2O+) column densities are found in the outflows of the sources. The ratios of H2O+/H2O are determined in a range from 0.01 to a few and are found to differ strongly between the observed environments with much lower ratios in the massive (proto) cluster envelopes (0.01-0.1) than in outflows and diffuse clouds. Remarkably, even for source components detected in H2O in emission, H2O+ is still seen in absorption.

The Heterodyne Instrument for the Far Infrared (HIFI) onboard the Herschel Space Observatory allows the first observations of light diatomic molecules at high spectral resolution and in multiple transitions. Here, we report deep integrations using HIFI in different lines of hydrides towards the high-mass star forming region AFGL 2591. Detected are CH, CH+, NH, OH+, H2O+, while NH+ and SH+ have not been detected. All molecules except for CH and CH+ are seen in absorption with low excitation temperatures and at velocities different from the systemic velocity of the protostellar envelope. Surprisingly, the CH(J(F,P) = 3/2(2),(-) - 1/2(1,+)) and CH+(J = 1-0, J = 2-1) lines are detected in emission at the systemic velocity. We can assign the absorption features to a foreground cloud and an outflow lobe, while the CH and CH+ emission stems from the envelope. The observed abundance and excitation of CH and CH+ can be explained in the scenario of FUV irradiated outflow walls, where a cavity etched out by the outflow allows protostellar FUV photons to irradiate and heat the envelope at larger distances driving the chemical reactions that produce these molecules.

We performed a sensitive search for the ground-state emission lines of ortho-and para-water vapor in the DM Tau protoplanetary disk using the Herschel/HIFI instrument. No strong lines are detected down to 3 sigma levels in 0.5 km s(-1) channels of 4.2 mK for the 1(10)-1(01) line and 12.6 mK for the 1(11)-0(00) line. We report a very tentative detection, however, of the 1(10)-1(01) line in the wide band spectrometer, with a strength of T-mb = 2.7 mK, a width of 5.6 km s(-1) and an integrated intensity of 16.0 mK km s(-1). The latter constitutes a 6 sigma detection. Regardless of the reality of this tentative detection, model calculations indicate that our sensitive limits on the line strengths preclude efficient desorption of water in the UV illuminated regions of the disk. We hypothesize that more than 95-99% of the water ice is locked up in coagulated grains that have settled to the midplane.

Herschel/HIFI observations of high-J lines (up to J(u) = 10) of (CO)-C-12, (CO)-C-13 and (CO)-O-18 are presented toward three deeply embedded low-mass protostars, NGC 1333 IRAS 2A, IRAS 4A, and IRAS 4B, obtained as part of the Water In Star-forming regions with Herschel (WISH) key program. The spectrally-resolved HIFI data are complemented by ground-based observations of lower-J CO and isotopologue lines. The (CO)-C-12 10-9 profiles are dominated by broad (FWHM 25-30 km s(-1)) emission. Radiative transfer models are used to constrain the temperature of this shocked gas to 100-200 K. Several CO and (CO)-C-13 line profiles also reveal a medium-broad component (FWHM5-10 km s(-1)), seen prominently in H2O lines. Column densities for both components are presented, providing a reference for determining abundances of other molecules in the same gas. The narrow (CO)-O-18 9-8 lines probe the warmer part of the quiescent envelope. Their intensities require a jump in the CO abundance at an evaporation temperature around 25 K, thus providing new direct evidence for a CO ice evaporation zone around low-mass protostars.

Water In Star-forming regions with Herschel (WISH) is a key programme dedicated to studying the role of water and related species during the star-formation process and constraining the physical and chemical properties of young stellar objects. The Heterodyne Instrument for the Far-Infrared (HIFI) on the Herschel Space Observatory observed three deeply embedded protostars in the low-mass star-forming region NGC 1333 in several (H2O)-O-16, (H2O)-O-18, and CO transitions. Line profiles are resolved for five (H2O)-O-16 transitions in each source, revealing them to be surprisingly complex. The line profiles are decomposed into broad (>20 km s(-1)), medium-broad (similar to 5-10 km s(-1)), and narrow (<5 kms(-1)) components. The (H2O)-O-18 emission is only detected in broad 1(10)-1(01) lines (>20 km s(-1)), indicating that its physical origin is the same as for the broad (H2O)-O-16 component. In one of the sources, IRAS4A, an inverse P Cygni profile is observed, a clear sign of infall in the envelope. From the line profiles alone, it is clear that the bulk of emission arises from shocks, both on small (less than or similar to 1000 AU) and large scales along the outflow cavity walls (similar to 10 000 AU). The H2O line profiles are compared to CO line profiles to constrain the H2O abundance as a function of velocity within these shocked regions. The H2O/CO abundance ratios are measured to be in the range of similar to 0.1-1, corresponding to H2O abundances of similar to 10(-5)-10(-4) with respect to H-2. Approximately 5-10% of the gas is hot enough for all oxygen to be driven into water in warm post-shock gas, mostly at high velocities.

We present Herschel observations of the water molecule in the massive star-forming region W3 IRS5. The o-(H2O)-O-17 1(10)-1(01), p-(H2O)-O-18 1(11)-0(00), p-H2O 2(02)-1(11), p-H2O 1(11)-0(00), o-H2O 2(21)-2(12), and o-H2O 2(12)-1(01) lines, covering a frequency range from 552 up to 1669 GHz, have been detected at high spectral resolution with HIFI. The water lines in W3 IRS5 show well-defined high-velocity wings that indicate a clear contribution by outflows. Moreover, the systematically blue-shifted absorption in the H2O lines suggests expansion, presumably driven by the outflow. No infall signatures are detected. The p-H2O 1(11)-0(00) and o-H2O 2(12)-1(01) lines show absorption from the cold material (T similar to 10 K) in which the high-mass protostellar envelope is embedded. One-dimensional radiative transfer models are used to estimate water abundances and to further study the kinematics of the region. We show that the emission in the rare isotopologues comes directly from the inner parts of the envelope (T greater than or similar to 100 K) where water ices in the dust mantles evaporate and the gas-phase abundance increases. The resulting jump in the water abundance (with a constant inner abundance of 10(-4)) is needed to reproduce the o-(H2O)-O-17 1(10)-1(01) and p-(H2O)-O-18 1(11)-0(00) spectra in our models. We estimate water abundances of 10(-8) to 10(-9) in the outer parts of the envelope (T less than or similar to 100 K). The possibility of two protostellar objects contributing to the emission is discussed.

Herschel/HIFI observations of water from the intermediate mass protostar NGC 7129 FIRS 2 provide a powerful diagnostic of the physical conditions in this star formation environment. Six spectral settings, covering four (H2O)-O-16 and two (H2O)-O-18 lines, were observed and all but one (H2O)-O-18 line were detected. The four (H2O)-O-16 lines discussed here share a similar morphology: a narrower, approximate to 6kms(-1), component centered slightly redward of the systemic velocity of NGC7129 FIRS 2 and a much broader, approximate to 25 km s(-1) component centered blueward and likely associated with powerful outflows. The narrower components are consistent with emission from water arising in the envelope around the intermediate mass protostar, and the abundance of H2O is constrained to approximate to 10(-7) for the outer envelope. Additionally, the presence of a narrow self-absorption component for the lowest energy lines is likely due to self-absorption from colder water in the outer envelope. The broader component, where the H2O/CO relative abundance is found to be approximate to 0.2, appears to be tracing the same energetic region that produces strong CO emission at high J.

Aims. Water In Star-forming regions with Herschel (WISH) is a Herschel key program investigating the water chemistry in young stellar objects (YSOs) during protostellar evolution. Hydroxyl (OH) is one of the reactants in the chemical network most closely linked to the formation and destruction of H2O. High-temperature (T greater than or similar to 250 K) chemistry connects OH and H2O through the OH + H-2 double left right arrow H2O + H reactions. Formation of H2O from OH is efficient in the high-temperature regime found in shocks and the innermost part of protostellar envelopes. Moreover, in the presence of UV photons, OH can be produced from the photo-dissociation of H2O through H2O + gamma(UV) double right arrow OH + H. Methods. High-resolution spectroscopy of the 163.12 mu m triplet of OH towards HH 46 and NGC 1333 IRAS 2A was carried out with the Heterodyne Instrument for the Far Infrared (HIFI) on board the Herschel Space Observatory. The low-and intermediate-mass protostars HH 46, TMR 1, IRAS 15398-3359, DK Cha, NGC 7129 FIRS 2, and NGC 1333 IRAS 2A were observed with the Photodetector Array Camera and Spectrometer (PACS) on Herschel in four transitions of OH and two [OI] lines. Results. The OH transitions at 79, 84, 119, and 163 mu m and [OI] emission at 63 and 145 mu m were detected with PACS towards the class I low-mass YSOs as well as the intermediate-mass and class I Herbig Ae sources. No OH emission was detected from the class 0 YSO NGC 1333 IRAS 2A, though the 119 mu m was detected in absorption. With HIFI, the 163.12 mu m was not detected from HH 46 and only tentatively detected from NGC 1333 IRAS 2A. The combination of the PACS and HIFI results for HH 46 constrains the line width (FWHM greater than or similar to 11 km s(-1)) and indicates that the OH emission likely originates from shocked gas. This scenario is supported by trends of the OH flux increasing with the [OI] flux and the bolometric luminosity, as found in our sample. Similar OH line ratios

Context. Hydrides of the most abundant heavier elements are fundamental molecules in cosmic chemistry. Some of them trace gas irradiated by UV or X-rays. Aims. We explore the abundances of major hydrides in W3 IRS5, a prototypical region of high-mass star formation. Methods. W3 IRS5 was observed by HIFI on the Herschel Space Observatory with deep integration (similar or equal to 2500 s) in 8 spectral regions. Results. The target lines including CH, NH, H3O+, and the new molecules SH+, H2O+, and OH+ are detected. The H2O+ and OH+ J = 1-0 lines are found mostly in absorption, but also appear to exhibit weak emission (P-Cyg-like). Emission requires high density, thus originates most likely near the protostar. This is corroborated by the absence of line shifts relative to the young stellar object (YSO). In addition, H2O+ and OH+ also contain strong absorption components at a velocity shifted relative to W3 IRS5, which are attributed to foreground clouds. Conclusions. The molecular column densities derived from observations correlate well with the predictions of a model that assumes the main emission region is in outflow walls, heated and irradiated by protostellar UV radiation.

Aims. We derive the dense core structure and the water abundance in four massive star-forming regions in the hope of understanding the earliest stages of massive star formation. Methods. We present Herschel/HIFI observations of the para-H2O 1(11)-0(00) and 2(02)-1(11) and the para-(H2O)-O-18 1(11)-0(00) transitions. The envelope contribution to the line profiles is separated from contributions by outflows and foreground clouds. The envelope contribution is modeled with Monte-Carlo radiative transfer codes for dust and molecular lines (MC3D and RATRAN), and the water abundance and the turbulent velocity width as free parameters. Results. While the outflows are mostly seen in emission in high-J lines, envelopes are seen in absorption in ground-state lines, which are almost saturated. The derived water abundances range from 5 x 10(-10) to 4 x 10(-8) in the outer envelopes. We detect cold clouds surrounding the protostar envelope, thanks to the very high quality of the Herschel/HIFI data and the unique ability of water to probe them. Several foreground clouds are also detected along the line of sight. Conclusions. The low H2O abundances in massive dense cores are in accordance with the expectation that high densities and low temperatures lead to freeze-out of water on dust grains. The spread in abundance values is not clearly linked to physical properties of the sources.

We present Herschel observations of the water molecule in the massive star-forming region W3 IRS5. The o-(H2O)-O-17 1(10)-1(01), p-(H2O)-O-18 1(11)-0(00), p-H2O 2(02)-1(11), p-H2O 1(11)-0(00), o-H2O 2(21)-2(12), and o-H2O 2(12)-1(01) lines, covering a frequency range from 552 up to 1669 GHz, have been detected at high spectral resolution with HIFI. The water lines in W3 IRS5 show well-defined high-velocity wings that indicate a clear contribution by outflows. Moreover, the systematically blue-shifted absorption in the H2O lines suggests expansion, presumably driven by the outflow. No infall signatures are detected. The p-H2O 1(11)-0(00) and o-H2O 2(12)-1(01) lines show absorption from the cold material (T similar to 10 K) in which the high-mass protostellar envelope is embedded. One-dimensional radiative transfer models are used to estimate water abundances and to further study the kinematics of the region. We show that the emission in the rare isotopologues comes directly from the inner parts of the envelope (T greater than or similar to 100 K) where water ices in the dust mantles evaporate and the gas-phase abundance increases. The resulting jump in the water abundance (with a constant inner abundance of 10(-4)) is needed to reproduce the o-(H2O)-O-17 1(10)-1(01) and p-(H2O)-O-18 1(11)-0(00) spectra in our models. We estimate water abundances of 10(-8) to 10(-9) in the outer parts of the envelope (T less than or similar to 100 K). The possibility of two protostellar objects contributing to the emission is discussed.

Herschel/HIFI observations of water from the intermediate mass protostar NGC 7129 FIRS 2 provide a powerful diagnostic of the physical conditions in this star formation environment. Six spectral settings, covering four (H2O)-O-16 and two (H2O)-O-18 lines, were observed and all but one (H2O)-O-18 line were detected. The four (H2O)-O-16 lines discussed here share a similar morphology: a narrower, approximate to 6kms(-1), component centered slightly redward of the systemic velocity of NGC7129 FIRS 2 and a much broader, approximate to 25 km s(-1) component centered blueward and likely associated with powerful outflows. The narrower components are consistent with emission from water arising in the envelope around the intermediate mass protostar, and the abundance of H2O is constrained to approximate to 10(-7) for the outer envelope. Additionally, the presence of a narrow self-absorption component for the lowest energy lines is likely due to self-absorption from colder water in the outer envelope. The broader component, where the H2O/CO relative abundance is found to be approximate to 0.2, appears to be tracing the same energetic region that produces strong CO emission at high J.

Water In Star-forming regions with Herschel (WISH) is a key programme dedicated to studying the role of water and related species during the star-formation process and constraining the physical and chemical properties of young stellar objects. The Heterodyne Instrument for the Far-Infrared (HIFI) on the Herschel Space Observatory observed three deeply embedded protostars in the low-mass star-forming region NGC 1333 in several (H2O)-O-16, (H2O)-O-18, and CO transitions. Line profiles are resolved for five (H2O)-O-16 transitions in each source, revealing them to be surprisingly complex. The line profiles are decomposed into broad (>20 km s(-1)), medium-broad (similar to 5-10 km s(-1)), and narrow (<5 kms(-1)) components. The (H2O)-O-18 emission is only detected in broad 1(10)-1(01) lines (>20 km s(-1)), indicating that its physical origin is the same as for the broad (H2O)-O-16 component. In one of the sources, IRAS4A, an inverse P Cygni profile is observed, a clear sign of infall in the envelope. From the line profiles alone, it is clear that the bulk of emission arises from shocks, both on small (less than or similar to 1000 AU) and large scales along the outflow cavity walls (similar to 10 000 AU). The H2O line profiles are compared to CO line profiles to constrain the H2O abundance as a function of velocity within these shocked regions. The H2O/CO abundance ratios are measured to be in the range of similar to 0.1-1, corresponding to H2O abundances of similar to 10(-5)-10(-4) with respect to H-2. Approximately 5-10% of the gas is hot enough for all oxygen to be driven into water in warm post-shock gas, mostly at high velocities.

Early results from the Herschel Space Observatory revealed the water cation H2O+ to be an abundant ingredient of the interstellar medium. Here we present new observations of the H2O and H2O+ lines at 1113.3 and 1115.2 GHz using the Herschel Space Observatory toward a sample of high-mass star-forming regions to observationally study the relation between H2O and H2O+. Nine out of ten sources show absorption from H2O+ in a range of environments: the molecular clumps surrounding the forming and newly formed massive stars, bright high-velocity outflows associated with the massive protostars, and unrelated low-density clouds along the line of sight. Column densities per velocity component of H2O+ are found in the range of 10(12) to a few 10(13) cm(-2). The highest N(H2O+) column densities are found in the outflows of the sources. The ratios of H2O+/H2O are determined in a range from 0.01 to a few and are found to differ strongly between the observed environments with much lower ratios in the massive (proto) cluster envelopes (0.01-0.1) than in outflows and diffuse clouds. Remarkably, even for source components detected in H2O in emission, H2O+ is still seen in absorption.

Context. Hydrides of the most abundant heavier elements are fundamental molecules in cosmic chemistry. Some of them trace gas irradiated by UV or X-rays. Aims. We explore the abundances of major hydrides in W3 IRS5, a prototypical region of high-mass star formation. Methods. W3 IRS5 was observed by HIFI on the Herschel Space Observatory with deep integration (similar or equal to 2500 s) in 8 spectral regions. Results. The target lines including CH, NH, H3O+, and the new molecules SH+, H2O+, and OH+ are detected. The H2O+ and OH+ J = 1-0 lines are found mostly in absorption, but also appear to exhibit weak emission (P-Cyg-like). Emission requires high density, thus originates most likely near the protostar. This is corroborated by the absence of line shifts relative to the young stellar object (YSO). In addition, H2O+ and OH+ also contain strong absorption components at a velocity shifted relative to W3 IRS5, which are attributed to foreground clouds. Conclusions. The molecular column densities derived from observations correlate well with the predictions of a model that assumes the main emission region is in outflow walls, heated and irradiated by protostellar UV radiation.

The Heterodyne Instrument for the Far Infrared (HIFI) onboard the Herschel Space Observatory allows the first observations of light diatomic molecules at high spectral resolution and in multiple transitions. Here, we report deep integrations using HIFI in different lines of hydrides towards the high-mass star forming region AFGL 2591. Detected are CH, CH+, NH, OH+, H2O+, while NH+ and SH+ have not been detected. All molecules except for CH and CH+ are seen in absorption with low excitation temperatures and at velocities different from the systemic velocity of the protostellar envelope. Surprisingly, the CH(J(F,P) = 3/2(2),(-) - 1/2(1,+)) and CH+(J = 1-0, J = 2-1) lines are detected in emission at the systemic velocity. We can assign the absorption features to a foreground cloud and an outflow lobe, while the CH and CH+ emission stems from the envelope. The observed abundance and excitation of CH and CH+ can be explained in the scenario of FUV irradiated outflow walls, where a cavity etched out by the outflow allows protostellar FUV photons to irradiate and heat the envelope at larger distances driving the chemical reactions that produce these molecules.

Aims. We derive the dense core structure and the water abundance in four massive star-forming regions in the hope of understanding the earliest stages of massive star formation. Methods. We present Herschel/HIFI observations of the para-H2O 1(11)-0(00) and 2(02)-1(11) and the para-(H2O)-O-18 1(11)-0(00) transitions. The envelope contribution to the line profiles is separated from contributions by outflows and foreground clouds. The envelope contribution is modeled with Monte-Carlo radiative transfer codes for dust and molecular lines (MC3D and RATRAN), and the water abundance and the turbulent velocity width as free parameters. Results. While the outflows are mostly seen in emission in high-J lines, envelopes are seen in absorption in ground-state lines, which are almost saturated. The derived water abundances range from 5 x 10(-10) to 4 x 10(-8) in the outer envelopes. We detect cold clouds surrounding the protostar envelope, thanks to the very high quality of the Herschel/HIFI data and the unique ability of water to probe them. Several foreground clouds are also detected along the line of sight. Conclusions. The low H2O abundances in massive dense cores are in accordance with the expectation that high densities and low temperatures lead to freeze-out of water on dust grains. The spread in abundance values is not clearly linked to physical properties of the sources.

Aims. Water In Star-forming regions with Herschel (WISH) is a Herschel key program investigating the water chemistry in young stellar objects (YSOs) during protostellar evolution. Hydroxyl (OH) is one of the reactants in the chemical network most closely linked to the formation and destruction of H2O. High-temperature (T greater than or similar to 250 K) chemistry connects OH and H2O through the OH + H-2 double left right arrow H2O + H reactions. Formation of H2O from OH is efficient in the high-temperature regime found in shocks and the innermost part of protostellar envelopes. Moreover, in the presence of UV photons, OH can be produced from the photo-dissociation of H2O through H2O + gamma(UV) double right arrow OH + H. Methods. High-resolution spectroscopy of the 163.12 mu m triplet of OH towards HH 46 and NGC 1333 IRAS 2A was carried out with the Heterodyne Instrument for the Far Infrared (HIFI) on board the Herschel Space Observatory. The low-and intermediate-mass protostars HH 46, TMR 1, IRAS 15398-3359, DK Cha, NGC 7129 FIRS 2, and NGC 1333 IRAS 2A were observed with the Photodetector Array Camera and Spectrometer (PACS) on Herschel in four transitions of OH and two [OI] lines. Results. The OH transitions at 79, 84, 119, and 163 mu m and [OI] emission at 63 and 145 mu m were detected with PACS towards the class I low-mass YSOs as well as the intermediate-mass and class I Herbig Ae sources. No OH emission was detected from the class 0 YSO NGC 1333 IRAS 2A, though the 119 mu m was detected in absorption. With HIFI, the 163.12 mu m was not detected from HH 46 and only tentatively detected from NGC 1333 IRAS 2A. The combination of the PACS and HIFI results for HH 46 constrains the line width (FWHM greater than or similar to 11 km s(-1)) and indicates that the OH emission likely originates from shocked gas. This scenario is supported by trends of the OH flux increasing with the [OI] flux and the bolometric luminosity, as found in our sample. Similar OH line ratios

Herschel/HIFI observations of high-J lines (up to J(u) = 10) of (CO)-C-12, (CO)-C-13 and (CO)-O-18 are presented toward three deeply embedded low-mass protostars, NGC 1333 IRAS 2A, IRAS 4A, and IRAS 4B, obtained as part of the Water In Star-forming regions with Herschel (WISH) key program. The spectrally-resolved HIFI data are complemented by ground-based observations of lower-J CO and isotopologue lines. The (CO)-C-12 10-9 profiles are dominated by broad (FWHM 25-30 km s(-1)) emission. Radiative transfer models are used to constrain the temperature of this shocked gas to 100-200 K. Several CO and (CO)-C-13 line profiles also reveal a medium-broad component (FWHM5-10 km s(-1)), seen prominently in H2O lines. Column densities for both components are presented, providing a reference for determining abundances of other molecules in the same gas. The narrow (CO)-O-18 9-8 lines probe the warmer part of the quiescent envelope. Their intensities require a jump in the CO abundance at an evaporation temperature around 25 K, thus providing new direct evidence for a CO ice evaporation zone around low-mass protostars.

We performed a sensitive search for the ground-state emission lines of ortho-and para-water vapor in the DM Tau protoplanetary disk using the Herschel/HIFI instrument. No strong lines are detected down to 3 sigma levels in 0.5 km s(-1) channels of 4.2 mK for the 1(10)-1(01) line and 12.6 mK for the 1(11)-0(00) line. We report a very tentative detection, however, of the 1(10)-1(01) line in the wide band spectrometer, with a strength of T-mb = 2.7 mK, a width of 5.6 km s(-1) and an integrated intensity of 16.0 mK km s(-1). The latter constitutes a 6 sigma detection. Regardless of the reality of this tentative detection, model calculations indicate that our sensitive limits on the line strengths preclude efficient desorption of water in the UV illuminated regions of the disk. We hypothesize that more than 95-99% of the water ice is locked up in coagulated grains that have settled to the midplane.